data_2lam_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lam _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 120.406 -0.108 . . . . 0.0 113.102 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.54 64.1 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.949 0.375 . . . . 0.0 110.885 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.475 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 83.1 Cg_endo -79.02 40.39 0.93 Allowed 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.748 2.299 . . . . 0.0 112.418 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -85.57 23.26 1.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.489 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.8 m -89.75 -33.76 16.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.08 39.29 73.39 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -140.87 149.5 42.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.078 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -122.56 112.68 18.3 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.815 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.448 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.6 p -88.61 60.93 5.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.314 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.6 p -58.09 -35.08 70.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.997 0.427 . . . . 0.0 110.337 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.4 mt -82.08 -21.14 36.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.938 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.04 40.84 2.75 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.191 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.3 m -157.68 133.06 8.95 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.214 0.205 . . . . 0.0 110.477 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.3 m -118.17 119.98 36.35 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -81.38 -21.01 39.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.218 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.51 HG13 ' HD2' ' A' ' 17' ' ' PRO . 61.7 t -62.38 128.39 91.23 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.51 ' HD2' HG13 ' A' ' 16' ' ' VAL . 4.8 Cg_endo -51.27 125.37 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 123.437 2.758 . . . . 0.0 114.25 -177.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.8 t0 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.484 -1.235 . . . . 0.0 113.082 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.457 ' SG ' HG11 ' A' ' 16' ' ' VAL . 19.3 m -89.2 126.63 35.57 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 111.114 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.9 m -90.41 143.43 26.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.908 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.401 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.0 t -75.98 109.66 9.79 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.048 0.451 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.566 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.7 m -111.38 50.47 0.83 Allowed 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -20.79 130.48 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.321 -176.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.57 -2.76 55.04 Favored 'Cis proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.242 -1.566 . . . . 0.0 115.066 0.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.481 HG21 ' N ' ' A' ' 26' ' ' CYS . 29.7 mt -106.73 148.44 11.09 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 CA-C-O 121.215 0.531 . . . . 0.0 112.147 -178.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.481 ' N ' HG21 ' A' ' 25' ' ' ILE . 72.3 m -87.62 133.43 33.81 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 121.818 -0.551 . . . . 0.0 110.082 178.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.566 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.2 mtt -133.2 145.17 50.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 111.291 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.439 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.763 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.043 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.416 ' N ' HD23 ' A' ' 2' ' ' LEU . 3.0 mm? -89.43 115.94 65.04 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 117.102 0.451 . . . . 0.0 110.92 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.482 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.6 Cg_endo -79.26 40.17 0.91 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.72 2.28 . . . . 0.0 112.451 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -84.59 22.36 1.32 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.575 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 65.1 m -89.66 -34.57 16.22 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.713 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 39.08 85.37 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.503 ' OE1' HG21 ' A' ' 16' ' ' VAL . 68.3 tt0 -135.89 150.82 49.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.264 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 24' ' ' PRO . 18.1 m -121.9 108.17 13.13 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.814 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.6 p -89.04 61.52 5.89 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -57.69 -35.56 70.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.044 0.449 . . . . 0.0 110.544 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -81.68 -20.23 39.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.037 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.83 41.26 2.92 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.114 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.6 m -156.11 132.55 10.16 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.9 m -118.3 120.11 36.64 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -81.18 -20.75 40.53 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.126 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 19' ' ' CYS . 57.5 t -62.18 128.49 91.06 Favored Pre-proline 0 C--O 1.234 0.259 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -50.28 124.2 12.55 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 123.527 2.818 . . . . 0.0 114.342 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.4 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 36.3 t0 63.04 13.33 6.66 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.448 -1.251 . . . . 0.0 113.084 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 16' ' ' VAL . 17.0 m -89.5 126.98 35.8 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.262 -0.899 . . . . 0.0 111.254 179.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -90.04 143.73 26.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.607 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.7 t -78.09 105.5 9.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.915 0.388 . . . . 0.0 111.004 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.7 m -104.85 50.77 0.78 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.0 t90 -19.74 129.31 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 O-C-N 125.511 1.757 . . . . 0.0 114.351 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.432 ' O ' HG23 ' A' ' 8' ' ' THR . 87.0 Cg_endo -81.37 -15.99 30.9 Favored 'Cis proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.905 -1.706 . . . . 0.0 115.06 0.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.505 HG23 ' N ' ' A' ' 26' ' ' CYS . 25.5 mt -92.95 146.99 5.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 CA-C-O 121.535 0.683 . . . . 0.0 112.764 -177.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.505 ' N ' HG23 ' A' ' 25' ' ' ILE . 71.1 m -86.54 134.14 33.68 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.557 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.7 mtt -133.35 143.83 49.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 111.415 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.46 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.762 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 177.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 120.372 -0.127 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.62 114.7 61.59 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 117.14 0.47 . . . . 0.0 110.923 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 87.1 Cg_endo -79.61 40.27 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.716 2.278 . . . . 0.0 112.48 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.8 p -84.73 20.63 1.73 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.492 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.4 m -89.61 -35.8 15.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.808 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.52 37.89 90.15 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.512 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.632 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 20.2 tt0 -133.95 148.62 51.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.661 HG23 HG21 ' A' ' 10' ' ' THR . 13.5 m -116.75 108.66 16.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.105 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.3 p -89.06 61.63 5.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.661 HG21 HG23 ' A' ' 8' ' ' THR . 1.5 p -57.55 -36.14 71.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 0.0 110.598 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.67 -17.7 40.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.14 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.04 42.85 2.95 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.038 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 m -155.46 134.75 12.35 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 47.2 m -121.66 121.28 37.0 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -81.22 -24.42 37.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.233 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.562 HG13 ' SG ' ' A' ' 19' ' ' CYS . 97.1 t -60.55 125.87 83.46 Favored Pre-proline 0 C--O 1.233 0.225 0 CA-C-O 121.02 0.438 . . . . 0.0 110.373 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -43.69 123.61 3.93 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 123.958 3.106 . . . . 0.0 114.93 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.414 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 21.3 t0 60.94 13.58 4.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.463 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.562 ' SG ' HG13 ' A' ' 16' ' ' VAL . 11.2 m -88.71 125.44 34.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 121.327 -0.858 . . . . 0.0 111.308 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 m -89.97 142.26 27.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.521 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -74.8 115.23 14.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.408 . . . . 0.0 110.834 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.567 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.0 m -115.21 49.14 1.09 Allowed 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -17.64 129.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.318 0 CA-C-N 113.021 -1.899 . . . . 0.0 114.605 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.55 -18.54 24.47 Favored 'Cis proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.885 -1.714 . . . . 0.0 114.934 -0.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.407 HD12 HG23 ' A' ' 25' ' ' ILE . 27.7 mt -91.95 147.96 4.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.29 134.96 33.71 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.567 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.2 mtt -134.6 141.27 46.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.307 0.575 . . . . 0.0 111.217 -179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.524 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.32 -0.682 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.69 115.31 63.53 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 117.171 0.486 . . . . 0.0 110.782 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.438 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.4 Cg_endo -78.75 40.32 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.775 2.317 . . . . 0.0 112.687 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.1 p -84.7 27.92 0.7 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.382 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.6 m -96.68 -35.2 11.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.24 38.03 87.24 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.623 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -138.68 146.43 41.59 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.8 p -116.97 112.3 20.8 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.087 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.3 p -88.83 61.12 5.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.277 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.1 p -58.29 -35.09 71.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.068 0.461 . . . . 0.0 110.386 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.95 -21.02 34.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.005 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.95 42.51 2.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.253 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 37.2 m -157.6 135.15 10.51 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.623 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 55.6 m -121.13 120.97 36.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.5 -25.61 35.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.428 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.633 HG12 ' SG ' ' A' ' 19' ' ' CYS . 85.6 t -60.45 127.39 86.54 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.049 0.452 . . . . 0.0 110.44 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -43.43 123.4 3.57 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 124.021 3.147 . . . . 0.0 114.955 -178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.71 16.86 5.82 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.517 -1.219 . . . . 0.0 113.286 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.633 ' SG ' HG12 ' A' ' 16' ' ' VAL . 18.0 m -89.27 125.24 35.01 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.19 -0.944 . . . . 0.0 111.036 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -89.87 142.64 27.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.519 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -75.2 110.84 9.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.067 0.46 . . . . 0.0 111.07 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.7 m -111.97 49.79 0.89 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.9 t90 -19.87 130.57 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 CA-C-N 113.172 -1.831 . . . . 0.0 114.356 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.36 -2.9 54.31 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.227 -1.572 . . . . 0.0 115.139 0.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.496 HD13 HG21 ' A' ' 25' ' ' ILE . 29.6 mt -107.25 148.35 11.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 CA-C-O 121.253 0.549 . . . . 0.0 112.08 -178.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.41 134.27 33.72 Favored 'General case' 0 C--N 1.317 -0.837 0 O-C-N 121.798 -0.564 . . . . 0.0 110.254 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -134.92 143.72 47.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.214 0.531 . . . . 0.0 111.047 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.468 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.67 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.5 63.99 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 117.033 0.416 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.542 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -78.93 39.97 0.87 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.3 p -84.49 23.82 1.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.519 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 85.2 m -89.65 -33.59 16.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.601 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.23 37.57 86.77 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.521 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.63 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -135.1 147.53 49.56 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 m -117.4 108.37 15.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.005 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.3 p -88.89 61.5 5.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.382 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.5 p -57.89 -35.5 71.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.052 0.453 . . . . 0.0 110.455 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.68 -19.81 40.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.02 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.36 41.24 3.03 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.181 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 24.9 m -156.7 132.95 9.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.63 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 45.7 m -117.44 122.24 43.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -81.1 -24.68 37.54 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.123 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.52 HG12 ' HD2' ' A' ' 17' ' ' PRO . 92.0 t -60.25 127.61 86.46 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.52 ' HD2' HG12 ' A' ' 16' ' ' VAL . 6.7 Cg_endo -52.55 127.92 26.09 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.352 2.701 . . . . 0.0 114.225 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.404 ' CG ' ' HZ2' ' A' ' 28' ' ' LYS . 32.8 t0 65.23 9.08 5.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.148 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.517 ' SG ' HG13 ' A' ' 16' ' ' VAL . 14.8 m -89.11 125.49 35.05 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.444 -0.785 . . . . 0.0 111.261 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.8 m -90.25 141.19 28.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.722 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -75.94 112.57 12.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.002 0.429 . . . . 0.0 110.704 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.6 m -112.86 50.19 0.89 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -17.98 129.14 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.786 1.929 . . . . 0.0 114.539 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.29 -16.88 28.81 Favored 'Cis proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.97 -1.679 . . . . 0.0 114.921 -0.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.553 HG21 ' N ' ' A' ' 26' ' ' CYS . 25.9 mt -93.13 147.88 5.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.553 ' N ' HG21 ' A' ' 25' ' ' ILE . 64.5 m -86.87 134.92 33.49 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.0 mtt -131.13 144.47 51.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.291 0.567 . . . . 0.0 111.281 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.446 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 CA-C-O 120.399 -0.112 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.71 115.63 64.33 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 117.048 0.424 . . . . 0.0 110.885 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.499 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -79.27 41.25 1.06 Allowed 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.789 2.326 . . . . 0.0 112.401 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.9 p -84.08 22.04 1.26 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.476 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 66.7 m -89.75 -34.72 16.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.741 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.47 37.26 89.86 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.507 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.5 tt0 -134.2 147.79 50.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 m -116.98 108.36 15.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.026 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.9 p -88.94 61.25 5.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.381 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.5 p -57.98 -35.4 71.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.063 0.458 . . . . 0.0 110.449 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.402 ' HA ' HD22 ' A' ' 11' ' ' LEU . 93.9 mt -81.86 -20.15 39.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.998 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.69 41.77 2.84 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.197 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 m -156.76 133.52 10.2 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.4 m -118.74 122.14 41.75 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -81.06 -24.86 37.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.496 HG11 ' HD2' ' A' ' 17' ' ' PRO . 99.2 t -59.74 128.17 86.17 Favored Pre-proline 0 C--O 1.233 0.221 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD2' HG11 ' A' ' 16' ' ' VAL . 5.6 Cg_endo -51.68 126.89 20.99 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.542 2.828 . . . . 0.0 114.254 -177.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.0 t0 64.17 11.13 6.03 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 114.499 -1.228 . . . . 0.0 113.059 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.438 ' SG ' HG12 ' A' ' 16' ' ' VAL . 13.1 m -89.18 124.9 34.78 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.344 -0.848 . . . . 0.0 111.259 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -89.98 141.23 28.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.621 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.6 t -75.56 112.18 11.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 54.2 m -111.87 49.78 0.88 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -18.06 129.3 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 113.048 -1.887 . . . . 0.0 114.499 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.02 -17.22 27.96 Favored 'Cis proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.986 -1.673 . . . . 0.0 114.871 -0.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.508 HG21 ' N ' ' A' ' 26' ' ' CYS . 25.4 mt -92.81 147.8 5.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' N ' HG21 ' A' ' 25' ' ' ILE . 66.5 m -86.43 134.78 33.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.1 mtt -132.82 144.26 50.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.368 0.604 . . . . 0.0 111.249 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.454 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.721 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.338 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -93.48 118.25 67.53 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 117.222 0.511 . . . . 0.0 110.675 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -74.68 38.84 0.53 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.744 2.296 . . . . 0.0 112.924 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -81.73 52.42 1.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.007 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.5 m -140.06 -43.32 0.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.235 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.32 35.21 76.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.379 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.604 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 19.3 tt0 -121.92 149.3 43.62 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.0 m -115.51 107.37 15.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.934 0.397 . . . . 0.0 110.366 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.3 p -89.17 61.39 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.207 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.5 p -57.39 -35.94 70.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.012 0.434 . . . . 0.0 110.577 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.402 ' HA ' HD22 ' A' ' 11' ' ' LEU . 94.0 mt -83.13 -17.79 41.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.83 41.96 3.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.883 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.0 m -156.13 134.23 11.33 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.313 0.245 . . . . 0.0 110.353 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 36.4 m -118.9 121.02 39.01 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -81.06 -25.26 37.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.063 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.525 HG13 ' SG ' ' A' ' 19' ' ' CYS . 87.5 t -62.76 125.94 87.48 Favored Pre-proline 0 C--O 1.235 0.309 0 CA-C-O 121.028 0.442 . . . . 0.0 109.952 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD2' HG12 ' A' ' 16' ' ' VAL . 20.3 Cg_endo -63.23 138.09 64.7 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.711 2.274 . . . . 0.0 112.831 -179.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 33.2 t0 65.65 45.76 2.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.431 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.525 ' SG ' HG13 ' A' ' 16' ' ' VAL . 64.0 m -143.41 127.25 17.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -99.79 145.25 27.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.329 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -71.98 117.64 13.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.001 0.429 . . . . 0.0 110.671 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.522 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.2 m -117.93 47.1 1.63 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -16.47 129.06 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.773 1.921 . . . . 0.0 114.718 -176.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -79.55 -21.04 18.33 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.89 -1.713 . . . . 0.0 114.962 -0.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.562 HG21 ' N ' ' A' ' 26' ' ' CYS . 28.2 mt -90.38 148.35 4.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.605 0 CA-C-O 121.452 0.644 . . . . 0.0 112.579 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.562 ' N ' HG21 ' A' ' 25' ' ' ILE . 81.4 m -86.24 131.08 34.31 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 121.944 -0.472 . . . . 0.0 109.729 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.522 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.4 mtm -134.43 142.53 47.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.353 0.597 . . . . 0.0 111.196 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt . . . . . 0 C--N 1.317 -0.842 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.871 178.289 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 CA-C-O 120.351 -0.138 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.56 114.46 60.63 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 117.124 0.462 . . . . 0.0 110.724 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.3 Cg_endo -76.29 37.89 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.662 2.241 . . . . 0.0 112.756 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -86.7 40.1 0.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.124 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.7 m -108.87 -34.55 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.665 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.7 41.4 56.7 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.615 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.8 tt0 -143.99 147.28 33.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.8 p -119.37 111.78 18.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.85 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.3 p -88.55 61.72 6.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.439 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.37 -34.0 70.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 110.43 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.4 mt -80.45 -22.22 41.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.948 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.13 39.07 3.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.273 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 23.0 m -158.9 130.91 6.6 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 122.296 0.238 . . . . 0.0 110.391 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 58.2 m -111.85 121.78 45.99 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -81.25 -25.75 36.36 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.528 HG12 ' SG ' ' A' ' 19' ' ' CYS . 74.5 t -62.19 124.35 81.9 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 121.073 0.463 . . . . 0.0 109.911 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.85 138.69 64.52 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.642 2.228 . . . . 0.0 112.618 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.5 t0 66.85 45.55 1.84 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.403 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.528 ' SG ' HG12 ' A' ' 16' ' ' VAL . 51.8 m -145.02 130.38 18.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.736 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m -97.61 148.63 23.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.523 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -79.75 103.79 9.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.936 0.398 . . . . 0.0 111.056 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.551 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.0 m -104.23 52.17 0.76 Allowed 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 178.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 58.5 t90 -22.01 130.3 0.07 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 125.278 1.611 . . . . 0.0 114.142 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -84.75 1.57 62.25 Favored 'Cis proline' 0 C--N 1.346 0.405 0 C-N-CA 123.235 -1.569 . . . . 0.0 115.134 0.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.497 HG23 ' N ' ' A' ' 26' ' ' CYS . 27.6 mt -110.5 146.84 15.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 112.182 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.497 ' N ' HG23 ' A' ' 25' ' ' ILE . 67.7 m -85.43 132.44 34.22 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 121.805 -0.559 . . . . 0.0 110.161 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.551 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.1 mtt -133.43 144.54 49.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.173 0.511 . . . . 0.0 111.057 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt . . . . . 0 C--N 1.318 -0.774 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.016 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.73 116.44 66.5 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 117.196 0.498 . . . . 0.0 110.936 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -78.86 40.25 0.91 Allowed 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.776 2.318 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.6 p -85.79 21.93 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.467 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.4 m -89.65 -34.49 16.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.63 37.51 89.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.193 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.625 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -138.24 146.68 42.87 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -117.12 112.53 21.0 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.41 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.9 p -88.81 60.65 5.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.9 p -58.15 -35.02 70.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.004 0.43 . . . . 0.0 110.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -20.56 34.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.976 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.55 42.16 2.58 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.213 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.4 m -157.93 134.91 9.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.625 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.9 m -120.33 120.92 37.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -81.25 -25.67 36.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.492 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.536 HG11 ' SG ' ' A' ' 19' ' ' CYS . 89.2 t -60.37 126.97 85.76 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 121.022 0.439 . . . . 0.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -43.55 123.93 3.96 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.957 3.104 . . . . 0.0 114.869 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 60.27 15.87 5.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.399 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.536 ' SG ' HG11 ' A' ' 16' ' ' VAL . 16.3 m -89.24 124.81 34.72 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 121.185 -0.947 . . . . 0.0 110.973 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m -89.79 141.48 28.58 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.617 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -73.97 114.47 12.33 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.16 0.505 . . . . 0.0 110.942 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.548 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.7 m -115.52 48.54 1.18 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.3 t90 -18.94 130.01 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 125.553 1.783 . . . . 0.0 114.443 -176.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -82.97 -5.03 51.29 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.168 -1.597 . . . . 0.0 115.15 0.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.475 HG21 ' N ' ' A' ' 26' ' ' CYS . 30.7 mt -105.39 149.0 9.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 CA-C-O 121.144 0.497 . . . . 0.0 112.097 -178.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.475 ' N ' HG21 ' A' ' 25' ' ' ILE . 68.3 m -88.07 133.39 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.737 -0.602 . . . . 0.0 110.347 178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -132.97 142.15 48.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.282 0.563 . . . . 0.0 111.205 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.454 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.786 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 120.501 -0.055 . . . . 0.0 113.083 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.407 ' C ' ' H ' ' A' ' 4' ' ' THR . 2.8 mm? -91.56 115.84 65.28 Favored Pre-proline 0 C--N 1.328 -0.341 0 O-C-N 122.492 -0.417 . . . . 0.0 110.699 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.422 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.5 Cg_endo -75.86 36.97 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.624 2.216 . . . . 0.0 112.555 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 2' ' ' LEU . 70.1 p -86.18 42.05 0.97 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.024 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.7 m -111.45 -35.49 5.8 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.482 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.0 42.21 69.17 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.429 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.403 ' OE1' HG21 ' A' ' 16' ' ' VAL . 69.1 tt0 -138.55 151.49 47.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.841 0.353 . . . . 0.0 110.465 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.559 HG23 HG21 ' A' ' 10' ' ' THR . 18.7 m -122.42 109.08 13.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.729 -0.668 . . . . 0.0 109.57 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.5 p -88.81 61.57 6.03 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.423 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.559 HG21 HG23 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.86 71.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.096 0.474 . . . . 0.0 110.452 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' A' ' 11' ' ' LEU . 92.3 mt -81.84 -20.94 37.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.986 179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.79 41.38 2.69 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.001 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.2 m -156.46 134.32 11.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 45.3 m -120.22 119.08 32.19 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -81.61 -20.53 39.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.955 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.564 HG13 ' SG ' ' A' ' 19' ' ' CYS . 89.7 t -62.38 129.61 92.58 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.829 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -47.71 134.0 22.0 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 123.71 2.94 . . . . 0.0 113.967 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.581 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 44.79 34.08 1.11 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.334 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.564 ' SG ' HG13 ' A' ' 16' ' ' VAL . 34.7 m -108.45 128.33 54.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.172 0.511 . . . . 0.0 110.561 178.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -92.46 143.92 25.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.871 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -75.19 110.72 9.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.947 0.403 . . . . 0.0 110.715 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 52.0 m -111.52 49.78 0.87 Allowed 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.68 128.65 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.256 0 O-C-N 125.651 1.844 . . . . 0.0 114.451 -176.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.405 ' O ' HG22 ' A' ' 8' ' ' THR . 89.1 Cg_endo -81.22 -19.4 22.58 Favored 'Cis proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.783 -1.757 . . . . 0.0 114.836 -0.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.409 HG21 HD13 ' A' ' 25' ' ' ILE . 26.2 mt -88.67 148.03 4.82 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-O 121.441 0.639 . . . . 0.0 112.713 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.2 m -89.42 132.84 34.8 Favored 'General case' 0 C--N 1.318 -0.764 0 O-C-N 122.017 -0.427 . . . . 0.0 109.945 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.557 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.7 mtt -128.14 141.84 51.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 110.754 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.581 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 8.3 ttpt . . . . . 0 C--N 1.316 -0.887 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 CA-C-O 120.418 -0.101 . . . . 0.0 113.17 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.74 115.6 64.27 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 117.133 0.466 . . . . 0.0 110.859 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.442 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.6 Cg_endo -78.89 40.57 0.95 Allowed 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.699 2.266 . . . . 0.0 112.591 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.3 p -85.07 29.92 0.62 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.358 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.4 m -99.36 -35.36 9.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.969 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.85 38.72 75.99 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -138.79 151.92 47.46 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.079 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 t -125.08 114.51 19.16 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.44 0.638 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.459 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.4 p -89.5 60.73 5.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.263 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.19 -36.43 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.078 0.466 . . . . 0.0 110.497 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.73 -19.8 37.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.96 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.46 41.98 2.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.235 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.5 m -156.97 134.13 10.43 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.5 m -120.46 119.15 32.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -81.46 -20.72 39.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.327 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.491 HG11 ' SG ' ' A' ' 19' ' ' CYS . 66.7 t -63.23 126.25 88.8 Favored Pre-proline 0 C--O 1.233 0.233 0 CA-C-O 121.0 0.429 . . . . 0.0 110.349 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -43.99 122.53 3.56 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.946 3.098 . . . . 0.0 114.842 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.445 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 21.2 t0 61.48 13.19 4.9 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.4 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.491 ' SG ' HG11 ' A' ' 16' ' ' VAL . 21.2 m -88.74 127.39 35.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.356 -0.84 . . . . 0.0 111.089 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -91.02 144.08 26.03 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.872 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -75.06 111.14 9.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.045 0.45 . . . . 0.0 110.965 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 57.5 m -112.54 50.07 0.89 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.7 t90 -20.57 130.1 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 113.321 -1.763 . . . . 0.0 114.297 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.46 -8.6 45.95 Favored 'Cis proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.042 0.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.558 HG21 ' N ' ' A' ' 26' ' ' CYS . 29.1 mt -100.76 148.74 6.67 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.558 ' N ' HG21 ' A' ' 25' ' ' ILE . 86.4 m -87.72 133.17 33.9 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 121.822 -0.548 . . . . 0.0 109.764 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 48.1 mtt -134.89 145.66 48.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.255 0.55 . . . . 0.0 111.314 -178.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.51 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.725 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 120.325 -0.153 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.417 ' C ' ' H ' ' A' ' 4' ' ' THR . 2.8 mm? -97.53 119.56 62.5 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 117.157 0.479 . . . . 0.0 110.567 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.24 36.07 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.703 2.269 . . . . 0.0 112.738 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.417 ' H ' ' C ' ' A' ' 2' ' ' LEU . 71.4 p -84.77 49.34 1.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.831 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 58.6 m -125.29 -37.72 2.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.552 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.34 42.18 75.46 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.519 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.559 ' HB2' HG23 ' A' ' 16' ' ' VAL . 70.0 tt0 -135.81 152.16 50.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.889 0.376 . . . . 0.0 110.27 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.3 m -122.66 109.98 14.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.744 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.433 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.1 p -88.97 61.61 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.331 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.4 p -57.55 -36.49 71.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.7 mt -82.72 -19.26 38.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.095 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 42.0 2.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.02 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.0 m -156.17 135.18 11.98 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 38.4 m -121.95 118.69 29.46 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -81.67 -20.46 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.178 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.559 HG23 ' HB2' ' A' ' 7' ' ' GLU . 99.1 t -64.02 128.34 92.89 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.504 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.511 ' HD2' HG11 ' A' ' 16' ' ' VAL . 98.4 Cg_exo -40.68 129.79 2.67 Favored 'Trans proline' 0 C--O 1.237 0.449 0 C-N-CA 124.077 3.185 . . . . 0.0 114.719 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.532 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 43.76 30.78 0.4 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.76 179.257 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.55 ' SG ' HG12 ' A' ' 16' ' ' VAL . 52.8 m -101.29 125.65 47.94 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.197 0.523 . . . . 0.0 110.408 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 m -90.04 143.49 26.73 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.851 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -72.99 114.91 11.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.959 0.409 . . . . 0.0 110.664 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.521 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 67.6 m -115.31 48.0 1.24 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.3 t90 -17.99 128.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 125.647 1.842 . . . . 0.0 114.434 -176.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -80.34 -22.57 15.68 Favored 'Cis proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.737 -1.776 . . . . 0.0 114.82 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.529 HG22 ' N ' ' A' ' 26' ' ' CYS . 27.8 mt -85.9 148.83 4.47 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 CA-C-O 121.454 0.645 . . . . 0.0 112.666 -178.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.529 ' N ' HG22 ' A' ' 25' ' ' ILE . 78.4 m -90.41 131.73 36.01 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.886 -0.509 . . . . 0.0 110.004 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.521 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 43.6 mtm -129.6 140.1 51.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.431 0.634 . . . . 0.0 110.692 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 11.6 ttpt . . . . . 0 C--N 1.314 -0.959 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.939 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-O 120.277 -0.18 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 113.74 58.14 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 117.273 0.536 . . . . 0.0 110.929 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.45 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.1 Cg_endo -76.48 38.59 0.62 Allowed 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.708 2.272 . . . . 0.0 112.837 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -89.85 35.8 0.85 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.29 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.0 m -102.73 -34.55 8.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.72 40.49 65.37 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.703 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.6 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.9 tt0 -142.04 147.42 36.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.9 p -118.71 112.75 20.17 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.136 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.6 p -88.7 62.34 6.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.246 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -58.27 -35.01 71.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.069 0.461 . . . . 0.0 110.493 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.6 mt -83.12 -17.66 42.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.025 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.44 40.64 3.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.068 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.9 m -157.77 132.3 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.352 0.261 . . . . 0.0 110.353 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.6 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 56.0 m -115.47 120.25 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.9 p90 -81.14 -26.14 36.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.076 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.463 HG22 ' OE1' ' A' ' 7' ' ' GLU . 71.5 t -62.27 118.92 44.72 Favored Pre-proline 0 C--O 1.235 0.296 0 CA-C-O 121.146 0.498 . . . . 0.0 110.513 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -56.0 137.87 80.52 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.116 2.544 . . . . 0.0 112.805 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 42.1 t0 66.12 45.12 2.43 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.498 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 38.9 m -143.92 130.55 20.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.224 0.535 . . . . 0.0 110.81 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.0 m -99.85 146.95 26.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.637 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.55 115.34 16.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.033 0.444 . . . . 0.0 110.959 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -117.47 50.39 1.12 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -19.94 130.72 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.417 0 CA-C-N 113.21 -1.814 . . . . 0.0 114.4 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.03 -4.31 52.11 Favored 'Cis proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.266 -1.556 . . . . 0.0 115.074 0.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.529 HG23 ' N ' ' A' ' 26' ' ' CYS . 32.2 mt -106.26 148.7 10.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 CA-C-O 121.265 0.555 . . . . 0.0 112.156 -178.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.529 ' N ' HG23 ' A' ' 25' ' ' ILE . 72.3 m -87.24 134.61 33.52 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.865 -0.522 . . . . 0.0 110.254 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.9 mtt -132.07 143.04 49.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.24 0.543 . . . . 0.0 111.019 -179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 3.7 ttpt . . . . . 0 C--N 1.318 -0.78 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -94.07 117.19 67.14 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 117.2 0.5 . . . . 0.0 110.916 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.59 40.48 0.92 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.883 2.389 . . . . 0.0 112.413 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.9 p -86.61 22.7 1.83 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.498 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.1 m -89.62 -34.12 16.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.833 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.4 38.82 70.28 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.484 ' OE1' HG21 ' A' ' 16' ' ' VAL . 57.3 tt0 -139.93 152.53 46.45 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.078 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.3 t -126.29 114.84 18.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.453 0.644 . . . . 0.0 109.759 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.445 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 10.3 p -89.49 60.75 5.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.212 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.0 p -57.24 -36.31 70.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.152 0.501 . . . . 0.0 110.428 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 11' ' ' LEU . 93.3 mt -81.93 -19.13 41.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.982 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.66 40.5 3.14 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.038 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.2 m -157.51 132.7 8.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 122.17 0.188 . . . . 0.0 110.524 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 53.6 m -117.12 120.26 37.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -81.41 -20.64 39.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.167 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.662 HG12 ' SG ' ' A' ' 19' ' ' CYS . 77.3 t -62.69 126.67 88.97 Favored Pre-proline 0 C--O 1.233 0.2 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.471 ' HD2' HG11 ' A' ' 16' ' ' VAL . 8.0 Cg_endo -53.16 127.61 25.78 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.322 2.682 . . . . 0.0 114.013 -177.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.472 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 19.9 t0 66.97 5.48 4.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.604 -1.18 . . . . 0.0 113.134 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.662 ' SG ' HG12 ' A' ' 16' ' ' VAL . 18.9 m -88.39 129.01 35.52 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 121.488 -0.757 . . . . 0.0 111.186 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.31 143.45 26.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.056 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.44 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t -74.51 115.4 14.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.065 0.46 . . . . 0.0 110.798 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 60.8 m -117.28 49.51 1.19 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -20.04 129.72 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 125.46 1.725 . . . . 0.0 114.255 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.78 -11.97 40.09 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.105 -1.623 . . . . 0.0 115.174 0.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.572 HG22 ' N ' ' A' ' 26' ' ' CYS . 31.1 mt -98.24 149.82 5.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.62 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -177.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.572 ' N ' HG22 ' A' ' 25' ' ' ILE . 81.0 m -89.42 132.27 35.08 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.712 -0.617 . . . . 0.0 109.775 178.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.557 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -131.44 144.21 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.455 0.645 . . . . 0.0 111.539 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.472 ' HZ3' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-O 120.276 -0.18 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -95.16 116.63 66.52 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 117.237 0.518 . . . . 0.0 110.813 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.43 38.19 0.54 Allowed 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.736 2.291 . . . . 0.0 112.871 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -88.69 40.47 0.97 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.232 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 76.1 m -110.95 -34.57 6.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.694 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.33 42.07 66.48 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.995 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.611 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.3 tt0 -143.02 147.42 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.6 p -118.76 112.46 19.77 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.067 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.8 p -88.68 62.06 6.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.162 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.19 -34.7 70.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.088 0.471 . . . . 0.0 110.509 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.455 ' HA ' HD22 ' A' ' 11' ' ' LEU . 94.1 mt -82.73 -19.2 38.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.91 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.88 40.26 3.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.093 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 24.4 m -158.29 132.01 7.75 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 122.346 0.258 . . . . 0.0 110.363 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.611 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.7 m -113.89 121.45 44.0 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -81.1 -25.26 37.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.983 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.545 HG11 ' SG ' ' A' ' 19' ' ' CYS . 75.7 t -62.5 124.69 83.8 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.065 0.459 . . . . 0.0 109.834 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.53 138.17 63.59 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.644 2.23 . . . . 0.0 112.746 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 20.1 t0 66.59 44.52 2.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.592 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.545 ' SG ' HG11 ' A' ' 16' ' ' VAL . 51.3 m -143.03 130.55 21.19 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.612 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -99.29 145.8 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.864 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.93 116.22 15.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.047 0.451 . . . . 0.0 110.678 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.545 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 65.4 m -117.92 49.45 1.24 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -19.25 130.08 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 114.428 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.96 -5.16 51.12 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.195 -1.585 . . . . 0.0 115.123 0.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.514 HG23 ' N ' ' A' ' 26' ' ' CYS . 30.2 mt -105.53 148.97 9.32 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 CA-C-O 121.179 0.514 . . . . 0.0 112.113 -178.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.514 ' N ' HG23 ' A' ' 25' ' ' ILE . 76.1 m -87.85 132.18 34.28 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 121.773 -0.579 . . . . 0.0 110.271 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.545 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.1 mtm -129.87 141.82 50.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.492 0.663 . . . . 0.0 110.999 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 4.3 ttpt . . . . . 0 C--N 1.317 -0.818 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.845 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.75 115.13 63.1 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 117.165 0.483 . . . . 0.0 111.002 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.528 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.9 Cg_endo -79.19 39.63 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.768 2.312 . . . . 0.0 112.302 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -85.03 24.16 1.12 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.534 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 82.7 m -89.71 -32.88 16.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.685 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.79 40.77 89.66 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.251 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.571 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.6 tt0 -140.4 150.34 43.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.417 HG23 ' O ' ' A' ' 24' ' ' PRO . 18.1 m -121.42 109.64 15.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.286 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.8 p -88.83 62.34 6.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.4 p -57.74 -35.47 70.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.02 0.438 . . . . 0.0 110.617 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.7 mt -81.29 -20.07 41.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.954 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.42 40.26 3.25 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.08 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 29.7 m -157.75 129.28 6.8 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 122.219 0.208 . . . . 0.0 110.498 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.571 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 26.7 m -113.56 123.35 49.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -81.43 -23.0 37.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 19' ' ' CYS . 59.9 t -58.78 127.29 82.58 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.734 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.31 128.3 29.44 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.369 2.712 . . . . 0.0 114.288 -178.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.472 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 19.1 t0 64.99 6.77 3.6 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.581 -1.19 . . . . 0.0 113.307 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 16' ' ' VAL . 16.0 m -88.71 126.24 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.612 -0.68 . . . . 0.0 111.262 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.67 140.23 29.96 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.684 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.7 t -74.77 114.2 12.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.051 0.453 . . . . 0.0 110.629 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -114.51 49.98 0.99 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.14 129.14 0.04 OUTLIER Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 113.139 -1.846 . . . . 0.0 114.486 -176.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.417 ' O ' HG23 ' A' ' 8' ' ' THR . 83.3 Cg_endo -80.63 -18.71 24.09 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 C-N-CA 122.893 -1.711 . . . . 0.0 115.016 0.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.448 HD12 HG23 ' A' ' 25' ' ' ILE . 26.3 mt -91.98 147.72 5.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -87.18 134.34 33.54 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -131.49 143.12 50.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.346 0.593 . . . . 0.0 111.307 -179.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.491 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.358 -0.134 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.86 115.25 63.44 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 117.075 0.437 . . . . 0.0 110.918 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.546 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 79.4 Cg_endo -79.22 39.55 0.83 Allowed 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.735 2.29 . . . . 0.0 112.38 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.6 p -85.48 25.86 0.99 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.427 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.5 m -89.74 -32.94 16.76 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.925 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.84 41.55 82.29 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.18 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.577 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.7 tt0 -142.18 155.01 45.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.432 HG23 HG23 ' A' ' 10' ' ' THR . 25.0 m -126.89 110.11 12.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.33 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.5 p -88.93 62.89 6.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.301 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.432 HG23 HG23 ' A' ' 8' ' ' THR . 1.4 p -58.01 -35.77 71.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.004 0.431 . . . . 0.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -81.18 -20.14 41.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.952 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.29 39.78 3.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 24.1 m -157.66 129.1 6.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 122.238 0.215 . . . . 0.0 110.599 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.577 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 29.7 m -112.65 123.52 50.49 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -81.34 -23.55 37.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.592 HG11 ' SG ' ' A' ' 19' ' ' CYS . 62.5 t -58.23 126.74 79.06 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.686 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.73 129.41 34.88 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.344 2.696 . . . . 0.0 114.338 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.469 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 18.6 t0 65.3 5.09 2.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.559 -1.201 . . . . 0.0 113.429 178.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.592 ' SG ' HG11 ' A' ' 16' ' ' VAL . 14.3 m -88.3 126.78 35.35 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.55 -0.719 . . . . 0.0 111.29 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.7 140.07 30.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.704 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.7 115.66 14.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.035 0.445 . . . . 0.0 110.712 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 62.4 m -116.07 49.98 1.07 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 178.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 50.5 t90 -17.77 128.76 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 113.059 -1.882 . . . . 0.0 114.51 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -81.27 -18.85 23.95 Favored 'Cis proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.889 -1.713 . . . . 0.0 114.866 0.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.467 HG21 ' N ' ' A' ' 26' ' ' CYS . 26.5 mt -90.75 147.87 4.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.467 ' N ' HG21 ' A' ' 25' ' ' ILE . 64.0 m -88.02 134.45 33.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.8 mtt -130.88 142.8 50.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.311 0.577 . . . . 0.0 111.419 -179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.469 ' HZ3' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-O 120.36 -0.133 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.405 HD11 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.73 115.11 63.06 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 117.107 0.454 . . . . 0.0 110.9 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.477 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.5 Cg_endo -79.22 40.12 0.9 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.716 2.277 . . . . 0.0 112.405 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.1 p -85.78 23.14 1.48 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.472 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.0 m -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.84 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.45 38.25 79.76 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -139.98 148.84 42.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -120.99 114.2 21.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.31 0.576 . . . . 0.0 110.002 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.2 p -89.6 60.17 5.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.285 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.2 p -57.64 -35.81 71.0 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.119 0.485 . . . . 0.0 110.379 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.0 mt -81.62 -21.08 38.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.918 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.35 41.58 2.54 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.199 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.5 m -157.96 133.77 9.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.242 0.217 . . . . 0.0 110.468 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.4 m -118.59 121.06 39.3 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -81.19 -25.64 36.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.346 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.4 t -60.3 124.29 77.24 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-O 121.067 0.46 . . . . 0.0 110.422 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -45.65 126.37 8.77 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.824 3.016 . . . . 0.0 114.691 -178.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.459 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 20.2 t0 63.64 8.89 3.94 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.511 178.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -88.33 126.49 35.22 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.374 -0.829 . . . . 0.0 111.175 179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.5 m -90.21 144.41 25.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.797 -179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -76.65 111.94 12.69 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.028 0.442 . . . . 0.0 110.977 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.564 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.9 m -112.96 50.65 0.87 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -20.69 130.44 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.304 0 CA-C-N 113.277 -1.783 . . . . 0.0 114.284 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -82.57 -6.95 48.12 Favored 'Cis proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.094 -1.628 . . . . 0.0 115.086 0.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.559 HG23 ' N ' ' A' ' 26' ' ' CYS . 29.3 mt -103.4 148.55 8.27 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 CA-C-O 121.258 0.551 . . . . 0.0 112.381 -177.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.559 ' N ' HG23 ' A' ' 25' ' ' ILE . 72.0 m -86.55 133.61 33.71 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 121.86 -0.525 . . . . 0.0 109.889 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -134.03 142.92 47.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 111.249 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.752 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.395 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.155 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.72 115.94 65.12 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 117.074 0.437 . . . . 0.0 110.793 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.418 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.1 Cg_endo -78.69 40.34 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.688 2.259 . . . . 0.0 112.57 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.4 p -84.66 31.85 0.52 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.285 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.67 -35.39 9.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.922 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 38.54 84.82 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.234 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.636 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.0 tt0 -139.46 148.99 43.48 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 t -120.88 114.44 21.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.421 0.629 . . . . 0.0 109.871 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.7 p -89.58 60.47 5.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.268 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -57.46 -36.12 71.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.107 0.48 . . . . 0.0 110.452 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.24 -20.85 36.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.925 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.42 42.12 2.42 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.291 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 36.0 m -157.52 134.32 10.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.421 -0.215 . . . . 0.0 110.421 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.636 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.2 m -119.89 120.85 37.62 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.38 -25.4 36.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.302 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.629 HG11 ' SG ' ' A' ' 19' ' ' CYS . 98.3 t -60.15 125.1 80.38 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.072 0.463 . . . . 0.0 110.429 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.96 125.31 6.56 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 123.903 3.068 . . . . 0.0 114.779 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.451 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 20.1 t0 62.55 10.76 4.27 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.551 177.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' HG11 ' A' ' 16' ' ' VAL . 16.9 m -88.5 125.97 35.02 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.271 -0.893 . . . . 0.0 111.047 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 m -89.96 144.68 25.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.8 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -76.14 111.17 11.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.006 0.432 . . . . 0.0 110.901 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.558 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.5 m -111.96 50.29 0.86 Allowed 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -20.5 130.35 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.333 0 CA-C-N 113.259 -1.791 . . . . 0.0 114.274 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.52 -6.96 47.99 Favored 'Cis proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.129 0.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.43 HG22 HD12 ' A' ' 25' ' ' ILE . 29.6 mt -103.1 148.7 7.88 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-O 121.26 0.552 . . . . 0.0 112.318 -178.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.403 ' N ' HG21 ' A' ' 25' ' ' ILE . 74.5 m -86.59 133.55 33.71 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.857 -0.527 . . . . 0.0 109.966 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.558 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -135.17 144.77 47.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.276 0.56 . . . . 0.0 111.19 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.735 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.434 0 CA-C-O 120.339 -0.145 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.58 112.86 59.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 117.128 0.464 . . . . 0.0 110.895 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.45 40.67 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.687 2.258 . . . . 0.0 112.609 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -96.91 34.41 1.72 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 28' ' ' LYS . 57.6 m -101.72 -38.26 7.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.91 37.28 56.89 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.549 ' OE1' ' HB3' ' A' ' 14' ' ' CYS . 55.0 tt0 -133.54 152.75 51.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.63 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.4 p -128.69 115.1 17.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.251 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.531 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.7 p -89.22 61.43 5.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.053 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.1 -36.85 71.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.938 0.399 . . . . 0.0 110.548 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.4 mt -83.78 -18.31 38.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.756 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.32 41.14 2.84 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.151 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.1 m -156.45 133.19 10.26 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.874 -0.191 . . . . 0.0 110.854 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB3' ' OE1' ' A' ' 7' ' ' GLU . 31.8 m -121.97 119.41 31.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.3 p90 -81.91 -20.24 39.16 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.487 -178.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.64 HG12 ' SG ' ' A' ' 19' ' ' CYS . 49.2 t -64.55 121.41 72.72 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.222 0.534 . . . . 0.0 110.818 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.74 133.43 44.75 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.434 2.756 . . . . 0.0 113.681 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.589 ' HB3' ' HD2' ' A' ' 28' ' ' LYS . 29.7 t70 71.52 -5.18 1.68 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.347 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.64 ' SG ' HG12 ' A' ' 16' ' ' VAL . 62.2 m -88.2 129.3 35.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.569 0.699 . . . . 0.0 110.915 179.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m -100.27 148.78 24.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.818 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.456 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.4 t -75.03 116.57 15.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.931 0.396 . . . . 0.0 110.823 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.519 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 50.5 m -121.0 49.48 1.48 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 50.8 t90 -19.29 129.92 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.4 0 O-C-N 125.569 1.793 . . . . 0.0 114.459 -177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -81.84 -13.68 36.73 Favored 'Cis proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.174 -1.594 . . . . 0.0 114.827 0.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.406 HG22 HD11 ' A' ' 25' ' ' ILE . 30.3 mt -94.63 150.02 4.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 121.214 0.531 . . . . 0.0 112.25 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.8 m -92.78 128.5 38.66 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 121.798 -0.564 . . . . 0.0 110.337 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.519 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 53.4 mtt -118.49 135.07 54.59 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.589 ' HD2' ' HB3' ' A' ' 18' ' ' ASP . 10.4 ttpp . . . . . 0 C--N 1.307 -1.25 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.432 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 120.406 -0.108 . . . . 0.0 113.102 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.54 64.1 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.949 0.375 . . . . 0.0 110.885 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.475 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 83.1 Cg_endo -79.02 40.39 0.93 Allowed 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.748 2.299 . . . . 0.0 112.418 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -85.57 23.26 1.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.489 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.8 m -89.75 -33.76 16.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.08 39.29 73.39 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -140.87 149.5 42.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.078 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -122.56 112.68 18.3 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.815 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.448 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.6 p -88.61 60.93 5.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.314 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.6 p -58.09 -35.08 70.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.997 0.427 . . . . 0.0 110.337 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.4 mt -82.08 -21.14 36.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.938 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.04 40.84 2.75 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.191 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.3 m -157.68 133.06 8.95 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.214 0.205 . . . . 0.0 110.477 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.3 m -118.17 119.98 36.35 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -81.38 -21.01 39.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.218 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.51 HG13 ' HD2' ' A' ' 17' ' ' PRO . 61.7 t -62.38 128.39 91.23 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.51 ' HD2' HG13 ' A' ' 16' ' ' VAL . 4.8 Cg_endo -51.27 125.37 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 123.437 2.758 . . . . 0.0 114.25 -177.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.8 t0 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.484 -1.235 . . . . 0.0 113.082 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.457 ' SG ' HG11 ' A' ' 16' ' ' VAL . 19.3 m -89.2 126.63 35.57 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 111.114 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.9 m -90.41 143.43 26.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.908 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.401 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.0 t -75.98 109.66 9.79 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.048 0.451 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.566 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.7 m -111.38 50.47 0.83 Allowed 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -20.79 130.48 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.321 -176.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.57 -2.76 55.04 Favored 'Cis proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.242 -1.566 . . . . 0.0 115.066 0.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.481 HG21 ' N ' ' A' ' 26' ' ' CYS . 29.7 mt -106.73 148.44 11.09 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 CA-C-O 121.215 0.531 . . . . 0.0 112.147 -178.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.481 ' N ' HG21 ' A' ' 25' ' ' ILE . 72.3 m -87.62 133.43 33.81 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 121.818 -0.551 . . . . 0.0 110.082 178.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.566 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.2 mtt -133.2 145.17 50.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 111.291 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -108.16 104.22 13.59 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.314 -178.495 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.043 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.416 ' N ' HD23 ' A' ' 2' ' ' LEU . 3.0 mm? -89.43 115.94 65.04 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 117.102 0.451 . . . . 0.0 110.92 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.482 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.6 Cg_endo -79.26 40.17 0.91 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.72 2.28 . . . . 0.0 112.451 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -84.59 22.36 1.32 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.575 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 65.1 m -89.66 -34.57 16.22 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.713 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 39.08 85.37 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.503 ' OE1' HG21 ' A' ' 16' ' ' VAL . 68.3 tt0 -135.89 150.82 49.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.264 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 24' ' ' PRO . 18.1 m -121.9 108.17 13.13 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.814 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.6 p -89.04 61.52 5.89 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 p -57.69 -35.56 70.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.044 0.449 . . . . 0.0 110.544 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -81.68 -20.23 39.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.037 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.83 41.26 2.92 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.114 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.6 m -156.11 132.55 10.16 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.9 m -118.3 120.11 36.64 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -81.18 -20.75 40.53 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.126 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 19' ' ' CYS . 57.5 t -62.18 128.49 91.06 Favored Pre-proline 0 C--O 1.234 0.259 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -50.28 124.2 12.55 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 123.527 2.818 . . . . 0.0 114.342 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.4 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 36.3 t0 63.04 13.33 6.66 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.448 -1.251 . . . . 0.0 113.084 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 16' ' ' VAL . 17.0 m -89.5 126.98 35.8 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.262 -0.899 . . . . 0.0 111.254 179.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -90.04 143.73 26.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.607 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.7 t -78.09 105.5 9.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.915 0.388 . . . . 0.0 111.004 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.7 m -104.85 50.77 0.78 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.0 t90 -19.74 129.31 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 O-C-N 125.511 1.757 . . . . 0.0 114.351 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.432 ' O ' HG23 ' A' ' 8' ' ' THR . 87.0 Cg_endo -81.37 -15.99 30.9 Favored 'Cis proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.905 -1.706 . . . . 0.0 115.06 0.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.505 HG23 ' N ' ' A' ' 26' ' ' CYS . 25.5 mt -92.95 146.99 5.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 CA-C-O 121.535 0.683 . . . . 0.0 112.764 -177.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.505 ' N ' HG23 ' A' ' 25' ' ' ILE . 71.1 m -86.54 134.14 33.68 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.557 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.7 mtt -133.35 143.83 49.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 111.415 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.46 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -106.98 104.67 14.4 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 177.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.349 -178.403 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 120.372 -0.127 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.62 114.7 61.59 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 117.14 0.47 . . . . 0.0 110.923 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 87.1 Cg_endo -79.61 40.27 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.716 2.278 . . . . 0.0 112.48 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.8 p -84.73 20.63 1.73 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.492 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.4 m -89.61 -35.8 15.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.808 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.52 37.89 90.15 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.512 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.632 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 20.2 tt0 -133.95 148.62 51.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.661 HG23 HG21 ' A' ' 10' ' ' THR . 13.5 m -116.75 108.66 16.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.105 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.3 p -89.06 61.63 5.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.661 HG21 HG23 ' A' ' 8' ' ' THR . 1.5 p -57.55 -36.14 71.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 0.0 110.598 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.67 -17.7 40.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.14 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.04 42.85 2.95 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.038 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 m -155.46 134.75 12.35 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 47.2 m -121.66 121.28 37.0 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -81.22 -24.42 37.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.233 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.562 HG13 ' SG ' ' A' ' 19' ' ' CYS . 97.1 t -60.55 125.87 83.46 Favored Pre-proline 0 C--O 1.233 0.225 0 CA-C-O 121.02 0.438 . . . . 0.0 110.373 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -43.69 123.61 3.93 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 123.958 3.106 . . . . 0.0 114.93 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.414 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 21.3 t0 60.94 13.58 4.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.463 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.562 ' SG ' HG13 ' A' ' 16' ' ' VAL . 11.2 m -88.71 125.44 34.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 121.327 -0.858 . . . . 0.0 111.308 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 m -89.97 142.26 27.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.521 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -74.8 115.23 14.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.408 . . . . 0.0 110.834 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.567 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.0 m -115.21 49.14 1.09 Allowed 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -17.64 129.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.318 0 CA-C-N 113.021 -1.899 . . . . 0.0 114.605 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.55 -18.54 24.47 Favored 'Cis proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.885 -1.714 . . . . 0.0 114.934 -0.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.407 HD12 HG23 ' A' ' 25' ' ' ILE . 27.7 mt -91.95 147.96 4.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.29 134.96 33.71 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.567 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.2 mtt -134.6 141.27 46.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.307 0.575 . . . . 0.0 111.217 -179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.524 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -102.78 103.48 13.7 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.45 -178.659 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.69 115.31 63.53 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 117.171 0.486 . . . . 0.0 110.782 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.438 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.4 Cg_endo -78.75 40.32 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.775 2.317 . . . . 0.0 112.687 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.1 p -84.7 27.92 0.7 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.382 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.6 m -96.68 -35.2 11.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.24 38.03 87.24 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.623 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -138.68 146.43 41.59 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.8 p -116.97 112.3 20.8 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.087 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.3 p -88.83 61.12 5.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.277 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.1 p -58.29 -35.09 71.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.068 0.461 . . . . 0.0 110.386 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.95 -21.02 34.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.005 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.95 42.51 2.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.253 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 37.2 m -157.6 135.15 10.51 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.623 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 55.6 m -121.13 120.97 36.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.5 -25.61 35.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.428 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.633 HG12 ' SG ' ' A' ' 19' ' ' CYS . 85.6 t -60.45 127.39 86.54 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.049 0.452 . . . . 0.0 110.44 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -43.43 123.4 3.57 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 124.021 3.147 . . . . 0.0 114.955 -178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.71 16.86 5.82 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.517 -1.219 . . . . 0.0 113.286 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.633 ' SG ' HG12 ' A' ' 16' ' ' VAL . 18.0 m -89.27 125.24 35.01 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.19 -0.944 . . . . 0.0 111.036 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -89.87 142.64 27.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.519 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -75.2 110.84 9.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.067 0.46 . . . . 0.0 111.07 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.7 m -111.97 49.79 0.89 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.9 t90 -19.87 130.57 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 CA-C-N 113.172 -1.831 . . . . 0.0 114.356 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.36 -2.9 54.31 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.227 -1.572 . . . . 0.0 115.139 0.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.496 HD13 HG21 ' A' ' 25' ' ' ILE . 29.6 mt -107.25 148.35 11.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 CA-C-O 121.253 0.549 . . . . 0.0 112.08 -178.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.41 134.27 33.72 Favored 'General case' 0 C--N 1.317 -0.837 0 O-C-N 121.798 -0.564 . . . . 0.0 110.254 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -134.92 143.72 47.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.214 0.531 . . . . 0.0 111.047 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.468 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -105.88 103.23 12.68 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.135 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.415 -178.58 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.5 63.99 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 117.033 0.416 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.542 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -78.93 39.97 0.87 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.3 p -84.49 23.82 1.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.519 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 85.2 m -89.65 -33.59 16.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.601 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.23 37.57 86.77 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.521 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.63 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -135.1 147.53 49.56 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 m -117.4 108.37 15.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.005 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.3 p -88.89 61.5 5.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.382 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.5 p -57.89 -35.5 71.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.052 0.453 . . . . 0.0 110.455 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.68 -19.81 40.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.02 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.36 41.24 3.03 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.181 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 24.9 m -156.7 132.95 9.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.63 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 45.7 m -117.44 122.24 43.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -81.1 -24.68 37.54 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.123 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.52 HG12 ' HD2' ' A' ' 17' ' ' PRO . 92.0 t -60.25 127.61 86.46 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.52 ' HD2' HG12 ' A' ' 16' ' ' VAL . 6.7 Cg_endo -52.55 127.92 26.09 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.352 2.701 . . . . 0.0 114.225 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.404 ' CG ' ' HZ2' ' A' ' 28' ' ' LYS . 32.8 t0 65.23 9.08 5.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.148 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.517 ' SG ' HG13 ' A' ' 16' ' ' VAL . 14.8 m -89.11 125.49 35.05 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.444 -0.785 . . . . 0.0 111.261 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.8 m -90.25 141.19 28.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.722 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -75.94 112.57 12.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.002 0.429 . . . . 0.0 110.704 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.6 m -112.86 50.19 0.89 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -17.98 129.14 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.786 1.929 . . . . 0.0 114.539 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.29 -16.88 28.81 Favored 'Cis proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.97 -1.679 . . . . 0.0 114.921 -0.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.553 HG21 ' N ' ' A' ' 26' ' ' CYS . 25.9 mt -93.13 147.88 5.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.553 ' N ' HG21 ' A' ' 25' ' ' ILE . 64.5 m -86.87 134.92 33.49 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.0 mtt -131.13 144.47 51.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.291 0.567 . . . . 0.0 111.281 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.446 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -109.98 103.95 12.78 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.373 -178.355 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 CA-C-O 120.399 -0.112 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.71 115.63 64.33 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 117.048 0.424 . . . . 0.0 110.885 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.499 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -79.27 41.25 1.06 Allowed 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.789 2.326 . . . . 0.0 112.401 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.9 p -84.08 22.04 1.26 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.476 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 66.7 m -89.75 -34.72 16.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.741 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.47 37.26 89.86 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.507 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.5 tt0 -134.2 147.79 50.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 m -116.98 108.36 15.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.026 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.9 p -88.94 61.25 5.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.381 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.5 p -57.98 -35.4 71.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.063 0.458 . . . . 0.0 110.449 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.402 ' HA ' HD22 ' A' ' 11' ' ' LEU . 93.9 mt -81.86 -20.15 39.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.998 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.69 41.77 2.84 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.197 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 m -156.76 133.52 10.2 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.4 m -118.74 122.14 41.75 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -81.06 -24.86 37.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.496 HG11 ' HD2' ' A' ' 17' ' ' PRO . 99.2 t -59.74 128.17 86.17 Favored Pre-proline 0 C--O 1.233 0.221 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD2' HG11 ' A' ' 16' ' ' VAL . 5.6 Cg_endo -51.68 126.89 20.99 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.542 2.828 . . . . 0.0 114.254 -177.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.0 t0 64.17 11.13 6.03 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 114.499 -1.228 . . . . 0.0 113.059 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.438 ' SG ' HG12 ' A' ' 16' ' ' VAL . 13.1 m -89.18 124.9 34.78 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.344 -0.848 . . . . 0.0 111.259 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -89.98 141.23 28.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.621 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.6 t -75.56 112.18 11.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 54.2 m -111.87 49.78 0.88 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -18.06 129.3 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 113.048 -1.887 . . . . 0.0 114.499 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.02 -17.22 27.96 Favored 'Cis proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.986 -1.673 . . . . 0.0 114.871 -0.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.508 HG21 ' N ' ' A' ' 26' ' ' CYS . 25.4 mt -92.81 147.8 5.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' N ' HG21 ' A' ' 25' ' ' ILE . 66.5 m -86.43 134.78 33.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.1 mtt -132.82 144.26 50.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.368 0.604 . . . . 0.0 111.249 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.454 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -108.53 103.51 12.65 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.374 -178.467 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.338 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -93.48 118.25 67.53 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 117.222 0.511 . . . . 0.0 110.675 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -74.68 38.84 0.53 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.744 2.296 . . . . 0.0 112.924 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -81.73 52.42 1.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.007 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.5 m -140.06 -43.32 0.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.235 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.32 35.21 76.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.379 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.604 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 19.3 tt0 -121.92 149.3 43.62 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.0 m -115.51 107.37 15.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.934 0.397 . . . . 0.0 110.366 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.3 p -89.17 61.39 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.207 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.5 p -57.39 -35.94 70.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.012 0.434 . . . . 0.0 110.577 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.402 ' HA ' HD22 ' A' ' 11' ' ' LEU . 94.0 mt -83.13 -17.79 41.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.83 41.96 3.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.883 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.0 m -156.13 134.23 11.33 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.313 0.245 . . . . 0.0 110.353 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 36.4 m -118.9 121.02 39.01 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -81.06 -25.26 37.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.063 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.525 HG13 ' SG ' ' A' ' 19' ' ' CYS . 87.5 t -62.76 125.94 87.48 Favored Pre-proline 0 C--O 1.235 0.309 0 CA-C-O 121.028 0.442 . . . . 0.0 109.952 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD2' HG12 ' A' ' 16' ' ' VAL . 20.3 Cg_endo -63.23 138.09 64.7 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.711 2.274 . . . . 0.0 112.831 -179.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 33.2 t0 65.65 45.76 2.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.431 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.525 ' SG ' HG13 ' A' ' 16' ' ' VAL . 64.0 m -143.41 127.25 17.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -99.79 145.25 27.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.329 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -71.98 117.64 13.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.001 0.429 . . . . 0.0 110.671 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.522 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.2 m -117.93 47.1 1.63 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -16.47 129.06 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.773 1.921 . . . . 0.0 114.718 -176.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -79.55 -21.04 18.33 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.89 -1.713 . . . . 0.0 114.962 -0.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.562 HG21 ' N ' ' A' ' 26' ' ' CYS . 28.2 mt -90.38 148.35 4.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.605 0 CA-C-O 121.452 0.644 . . . . 0.0 112.579 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.562 ' N ' HG21 ' A' ' 25' ' ' ILE . 81.4 m -86.24 131.08 34.31 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 121.944 -0.472 . . . . 0.0 109.729 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.522 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.4 mtm -134.43 142.53 47.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.353 0.597 . . . . 0.0 111.196 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -95.78 101.87 13.6 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.871 178.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.091 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 CA-C-O 120.351 -0.138 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.56 114.46 60.63 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 117.124 0.462 . . . . 0.0 110.724 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.3 Cg_endo -76.29 37.89 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.662 2.241 . . . . 0.0 112.756 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -86.7 40.1 0.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.124 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.7 m -108.87 -34.55 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.665 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.7 41.4 56.7 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.615 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.8 tt0 -143.99 147.28 33.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.8 p -119.37 111.78 18.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.85 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.3 p -88.55 61.72 6.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.439 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.37 -34.0 70.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 110.43 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.4 mt -80.45 -22.22 41.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.948 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.13 39.07 3.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.273 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 23.0 m -158.9 130.91 6.6 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 122.296 0.238 . . . . 0.0 110.391 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 58.2 m -111.85 121.78 45.99 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -81.25 -25.75 36.36 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.528 HG12 ' SG ' ' A' ' 19' ' ' CYS . 74.5 t -62.19 124.35 81.9 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 121.073 0.463 . . . . 0.0 109.911 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.85 138.69 64.52 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.642 2.228 . . . . 0.0 112.618 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.5 t0 66.85 45.55 1.84 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.403 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.528 ' SG ' HG12 ' A' ' 16' ' ' VAL . 51.8 m -145.02 130.38 18.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.736 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m -97.61 148.63 23.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.523 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -79.75 103.79 9.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.936 0.398 . . . . 0.0 111.056 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.551 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.0 m -104.23 52.17 0.76 Allowed 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 178.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 58.5 t90 -22.01 130.3 0.07 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 125.278 1.611 . . . . 0.0 114.142 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -84.75 1.57 62.25 Favored 'Cis proline' 0 C--N 1.346 0.405 0 C-N-CA 123.235 -1.569 . . . . 0.0 115.134 0.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.497 HG23 ' N ' ' A' ' 26' ' ' CYS . 27.6 mt -110.5 146.84 15.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 112.182 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.497 ' N ' HG23 ' A' ' 25' ' ' ILE . 67.7 m -85.43 132.44 34.22 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 121.805 -0.559 . . . . 0.0 110.161 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.551 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.1 mtt -133.43 144.54 49.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.173 0.511 . . . . 0.0 111.057 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -102.45 105.43 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.797 -178.807 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.73 116.44 66.5 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 117.196 0.498 . . . . 0.0 110.936 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -78.86 40.25 0.91 Allowed 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.776 2.318 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.6 p -85.79 21.93 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.467 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.4 m -89.65 -34.49 16.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.63 37.51 89.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.193 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.625 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -138.24 146.68 42.87 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -117.12 112.53 21.0 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.9 p -88.81 60.65 5.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.9 p -58.15 -35.02 70.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.004 0.43 . . . . 0.0 110.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -20.56 34.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.976 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.55 42.16 2.58 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.213 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.4 m -157.93 134.91 9.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.625 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.9 m -120.33 120.92 37.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -81.25 -25.67 36.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.492 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.536 HG11 ' SG ' ' A' ' 19' ' ' CYS . 89.2 t -60.37 126.97 85.76 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 121.022 0.439 . . . . 0.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -43.55 123.93 3.96 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.957 3.104 . . . . 0.0 114.869 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 60.27 15.87 5.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.399 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.536 ' SG ' HG11 ' A' ' 16' ' ' VAL . 16.3 m -89.24 124.81 34.72 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 121.185 -0.947 . . . . 0.0 110.973 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m -89.79 141.48 28.58 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.617 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -73.97 114.47 12.33 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.16 0.505 . . . . 0.0 110.942 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.548 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.7 m -115.52 48.54 1.18 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.3 t90 -18.94 130.01 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 125.553 1.783 . . . . 0.0 114.443 -176.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -82.97 -5.03 51.29 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.168 -1.597 . . . . 0.0 115.15 0.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.475 HG21 ' N ' ' A' ' 26' ' ' CYS . 30.7 mt -105.39 149.0 9.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 CA-C-O 121.144 0.497 . . . . 0.0 112.097 -178.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.475 ' N ' HG21 ' A' ' 25' ' ' ILE . 68.3 m -88.07 133.39 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.737 -0.602 . . . . 0.0 110.347 178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -132.97 142.15 48.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.282 0.563 . . . . 0.0 111.205 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.454 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -105.04 106.67 17.27 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.179 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 . . . . . 0 N--CA 1.465 0.31 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.458 -178.779 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 120.501 -0.055 . . . . 0.0 113.083 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.407 ' C ' ' H ' ' A' ' 4' ' ' THR . 2.8 mm? -91.56 115.84 65.28 Favored Pre-proline 0 C--N 1.328 -0.341 0 O-C-N 122.492 -0.417 . . . . 0.0 110.699 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.422 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.5 Cg_endo -75.86 36.97 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.624 2.216 . . . . 0.0 112.555 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 2' ' ' LEU . 70.1 p -86.18 42.05 0.97 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.024 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.7 m -111.45 -35.49 5.8 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.482 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.0 42.21 69.17 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.429 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.403 ' OE1' HG21 ' A' ' 16' ' ' VAL . 69.1 tt0 -138.55 151.49 47.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.841 0.353 . . . . 0.0 110.465 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.559 HG23 HG21 ' A' ' 10' ' ' THR . 18.7 m -122.42 109.08 13.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.729 -0.668 . . . . 0.0 109.57 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.5 p -88.81 61.57 6.03 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.423 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.559 HG21 HG23 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.86 71.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.096 0.474 . . . . 0.0 110.452 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' A' ' 11' ' ' LEU . 92.3 mt -81.84 -20.94 37.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.986 179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.79 41.38 2.69 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.001 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.2 m -156.46 134.32 11.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 45.3 m -120.22 119.08 32.19 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -81.61 -20.53 39.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.955 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.564 HG13 ' SG ' ' A' ' 19' ' ' CYS . 89.7 t -62.38 129.61 92.58 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.829 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -47.71 134.0 22.0 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 123.71 2.94 . . . . 0.0 113.967 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.581 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 44.79 34.08 1.11 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.334 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.564 ' SG ' HG13 ' A' ' 16' ' ' VAL . 34.7 m -108.45 128.33 54.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.172 0.511 . . . . 0.0 110.561 178.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -92.46 143.92 25.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.871 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -75.19 110.72 9.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.947 0.403 . . . . 0.0 110.715 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 52.0 m -111.52 49.78 0.87 Allowed 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.68 128.65 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.256 0 O-C-N 125.651 1.844 . . . . 0.0 114.451 -176.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.405 ' O ' HG22 ' A' ' 8' ' ' THR . 89.1 Cg_endo -81.22 -19.4 22.58 Favored 'Cis proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.783 -1.757 . . . . 0.0 114.836 -0.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.409 HG21 HD13 ' A' ' 25' ' ' ILE . 26.2 mt -88.67 148.03 4.82 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-O 121.441 0.639 . . . . 0.0 112.713 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.2 m -89.42 132.84 34.8 Favored 'General case' 0 C--N 1.318 -0.764 0 O-C-N 122.017 -0.427 . . . . 0.0 109.945 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.557 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.7 mtt -128.14 141.84 51.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 110.754 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.581 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 8.3 ttpt -104.24 104.63 14.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.421 -178.53 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 CA-C-O 120.418 -0.101 . . . . 0.0 113.17 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.74 115.6 64.27 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 117.133 0.466 . . . . 0.0 110.859 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.6 Cg_endo -78.89 40.57 0.95 Allowed 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.699 2.266 . . . . 0.0 112.591 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.3 p -85.07 29.92 0.62 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.358 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.4 m -99.36 -35.36 9.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.969 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.85 38.72 75.99 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -138.79 151.92 47.46 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.079 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 t -125.08 114.51 19.16 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.44 0.638 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.459 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.4 p -89.5 60.73 5.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.263 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.19 -36.43 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.078 0.466 . . . . 0.0 110.497 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.73 -19.8 37.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.96 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.46 41.98 2.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.235 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.5 m -156.97 134.13 10.43 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.5 m -120.46 119.15 32.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -81.46 -20.72 39.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.327 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.491 HG11 ' SG ' ' A' ' 19' ' ' CYS . 66.7 t -63.23 126.25 88.8 Favored Pre-proline 0 C--O 1.233 0.233 0 CA-C-O 121.0 0.429 . . . . 0.0 110.349 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -43.99 122.53 3.56 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.946 3.098 . . . . 0.0 114.842 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.445 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 21.2 t0 61.48 13.19 4.9 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.4 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.491 ' SG ' HG11 ' A' ' 16' ' ' VAL . 21.2 m -88.74 127.39 35.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.356 -0.84 . . . . 0.0 111.089 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -91.02 144.08 26.03 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.872 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -75.06 111.14 9.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.045 0.45 . . . . 0.0 110.965 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 57.5 m -112.54 50.07 0.89 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.7 t90 -20.57 130.1 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 113.321 -1.763 . . . . 0.0 114.297 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.46 -8.6 45.95 Favored 'Cis proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.042 0.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.558 HG21 ' N ' ' A' ' 26' ' ' CYS . 29.1 mt -100.76 148.74 6.67 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.558 ' N ' HG21 ' A' ' 25' ' ' ILE . 86.4 m -87.72 133.17 33.9 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 121.822 -0.548 . . . . 0.0 109.764 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 48.1 mtt -134.89 145.66 48.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.255 0.55 . . . . 0.0 111.314 -178.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.51 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.36 103.88 13.44 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.032 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.438 -178.674 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 120.325 -0.153 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.417 ' C ' ' H ' ' A' ' 4' ' ' THR . 2.8 mm? -97.53 119.56 62.5 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 117.157 0.479 . . . . 0.0 110.567 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.24 36.07 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.703 2.269 . . . . 0.0 112.738 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.417 ' H ' ' C ' ' A' ' 2' ' ' LEU . 71.4 p -84.77 49.34 1.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.831 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 58.6 m -125.29 -37.72 2.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.552 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.34 42.18 75.46 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.519 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.559 ' HB2' HG23 ' A' ' 16' ' ' VAL . 70.0 tt0 -135.81 152.16 50.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.889 0.376 . . . . 0.0 110.27 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.3 m -122.66 109.98 14.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.744 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.433 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.1 p -88.97 61.61 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.331 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.4 p -57.55 -36.49 71.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.7 mt -82.72 -19.26 38.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.095 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 42.0 2.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.02 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.0 m -156.17 135.18 11.98 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 38.4 m -121.95 118.69 29.46 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -81.67 -20.46 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.178 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.559 HG23 ' HB2' ' A' ' 7' ' ' GLU . 99.1 t -64.02 128.34 92.89 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.504 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.511 ' HD2' HG11 ' A' ' 16' ' ' VAL . 98.4 Cg_exo -40.68 129.79 2.67 Favored 'Trans proline' 0 C--O 1.237 0.449 0 C-N-CA 124.077 3.185 . . . . 0.0 114.719 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.532 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 43.76 30.78 0.4 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.76 179.257 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.55 ' SG ' HG12 ' A' ' 16' ' ' VAL . 52.8 m -101.29 125.65 47.94 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.197 0.523 . . . . 0.0 110.408 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 m -90.04 143.49 26.73 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.851 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -72.99 114.91 11.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.959 0.409 . . . . 0.0 110.664 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.521 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 67.6 m -115.31 48.0 1.24 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.3 t90 -17.99 128.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 125.647 1.842 . . . . 0.0 114.434 -176.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -80.34 -22.57 15.68 Favored 'Cis proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.737 -1.776 . . . . 0.0 114.82 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.529 HG22 ' N ' ' A' ' 26' ' ' CYS . 27.8 mt -85.9 148.83 4.47 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 CA-C-O 121.454 0.645 . . . . 0.0 112.666 -178.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.529 ' N ' HG22 ' A' ' 25' ' ' ILE . 78.4 m -90.41 131.73 36.01 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.886 -0.509 . . . . 0.0 110.004 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.521 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 43.6 mtm -129.6 140.1 51.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.431 0.634 . . . . 0.0 110.692 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.532 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 11.6 ttpt -101.16 107.96 19.51 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.939 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.686 -178.897 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-O 120.277 -0.18 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 113.74 58.14 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 117.273 0.536 . . . . 0.0 110.929 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.45 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.1 Cg_endo -76.48 38.59 0.62 Allowed 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.708 2.272 . . . . 0.0 112.837 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -89.85 35.8 0.85 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.29 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.0 m -102.73 -34.55 8.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.72 40.49 65.37 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.703 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.6 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.9 tt0 -142.04 147.42 36.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.9 p -118.71 112.75 20.17 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.136 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.6 p -88.7 62.34 6.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.246 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -58.27 -35.01 71.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.069 0.461 . . . . 0.0 110.493 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.6 mt -83.12 -17.66 42.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.025 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.44 40.64 3.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.068 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.9 m -157.77 132.3 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.352 0.261 . . . . 0.0 110.353 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.6 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 56.0 m -115.47 120.25 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.9 p90 -81.14 -26.14 36.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.076 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.463 HG22 ' OE1' ' A' ' 7' ' ' GLU . 71.5 t -62.27 118.92 44.72 Favored Pre-proline 0 C--O 1.235 0.296 0 CA-C-O 121.146 0.498 . . . . 0.0 110.513 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -56.0 137.87 80.52 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.116 2.544 . . . . 0.0 112.805 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 42.1 t0 66.12 45.12 2.43 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.498 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 38.9 m -143.92 130.55 20.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.224 0.535 . . . . 0.0 110.81 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.0 m -99.85 146.95 26.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.637 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.55 115.34 16.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.033 0.444 . . . . 0.0 110.959 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -117.47 50.39 1.12 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -19.94 130.72 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.417 0 CA-C-N 113.21 -1.814 . . . . 0.0 114.4 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.03 -4.31 52.11 Favored 'Cis proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.266 -1.556 . . . . 0.0 115.074 0.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.529 HG23 ' N ' ' A' ' 26' ' ' CYS . 32.2 mt -106.26 148.7 10.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 CA-C-O 121.265 0.555 . . . . 0.0 112.156 -178.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.529 ' N ' HG23 ' A' ' 25' ' ' ILE . 72.3 m -87.24 134.61 33.52 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.865 -0.522 . . . . 0.0 110.254 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.9 mtt -132.07 143.04 49.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.24 0.543 . . . . 0.0 111.019 -179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 3.7 ttpt -99.1 103.98 15.94 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.85 -179.118 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -94.07 117.19 67.14 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 117.2 0.5 . . . . 0.0 110.916 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.59 40.48 0.92 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.883 2.389 . . . . 0.0 112.413 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.9 p -86.61 22.7 1.83 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.498 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.1 m -89.62 -34.12 16.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.833 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.4 38.82 70.28 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.484 ' OE1' HG21 ' A' ' 16' ' ' VAL . 57.3 tt0 -139.93 152.53 46.45 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.078 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.3 t -126.29 114.84 18.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.453 0.644 . . . . 0.0 109.759 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.445 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 10.3 p -89.49 60.75 5.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.212 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.0 p -57.24 -36.31 70.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.152 0.501 . . . . 0.0 110.428 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 11' ' ' LEU . 93.3 mt -81.93 -19.13 41.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.982 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.66 40.5 3.14 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.038 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.2 m -157.51 132.7 8.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 122.17 0.188 . . . . 0.0 110.524 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 53.6 m -117.12 120.26 37.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -81.41 -20.64 39.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.167 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.662 HG12 ' SG ' ' A' ' 19' ' ' CYS . 77.3 t -62.69 126.67 88.97 Favored Pre-proline 0 C--O 1.233 0.2 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.471 ' HD2' HG11 ' A' ' 16' ' ' VAL . 8.0 Cg_endo -53.16 127.61 25.78 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.322 2.682 . . . . 0.0 114.013 -177.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.472 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 19.9 t0 66.97 5.48 4.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.604 -1.18 . . . . 0.0 113.134 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.662 ' SG ' HG12 ' A' ' 16' ' ' VAL . 18.9 m -88.39 129.01 35.52 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 121.488 -0.757 . . . . 0.0 111.186 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.31 143.45 26.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.056 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.44 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t -74.51 115.4 14.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.065 0.46 . . . . 0.0 110.798 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 60.8 m -117.28 49.51 1.19 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -20.04 129.72 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 125.46 1.725 . . . . 0.0 114.255 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.78 -11.97 40.09 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.105 -1.623 . . . . 0.0 115.174 0.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.572 HG22 ' N ' ' A' ' 26' ' ' CYS . 31.1 mt -98.24 149.82 5.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.62 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -177.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.572 ' N ' HG22 ' A' ' 25' ' ' ILE . 81.0 m -89.42 132.27 35.08 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.712 -0.617 . . . . 0.0 109.775 178.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.557 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -131.44 144.21 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.455 0.645 . . . . 0.0 111.539 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.472 ' HZ3' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER -106.76 107.53 18.59 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.131 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.617 -178.806 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-O 120.276 -0.18 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -95.16 116.63 66.52 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 117.237 0.518 . . . . 0.0 110.813 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.43 38.19 0.54 Allowed 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.736 2.291 . . . . 0.0 112.871 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -88.69 40.47 0.97 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.232 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 76.1 m -110.95 -34.57 6.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.694 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.33 42.07 66.48 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.995 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.611 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.3 tt0 -143.02 147.42 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.6 p -118.76 112.46 19.77 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.067 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.8 p -88.68 62.06 6.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.162 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.19 -34.7 70.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.088 0.471 . . . . 0.0 110.509 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.455 ' HA ' HD22 ' A' ' 11' ' ' LEU . 94.1 mt -82.73 -19.2 38.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.91 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.88 40.26 3.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.093 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 24.4 m -158.29 132.01 7.75 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 122.346 0.258 . . . . 0.0 110.363 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.611 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.7 m -113.89 121.45 44.0 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -81.1 -25.26 37.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.983 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.545 HG11 ' SG ' ' A' ' 19' ' ' CYS . 75.7 t -62.5 124.69 83.8 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.065 0.459 . . . . 0.0 109.834 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.53 138.17 63.59 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.644 2.23 . . . . 0.0 112.746 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 20.1 t0 66.59 44.52 2.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.592 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.545 ' SG ' HG11 ' A' ' 16' ' ' VAL . 51.3 m -143.03 130.55 21.19 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.612 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -99.29 145.8 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.864 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.93 116.22 15.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.047 0.451 . . . . 0.0 110.678 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.545 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 65.4 m -117.92 49.45 1.24 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -19.25 130.08 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 114.428 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.96 -5.16 51.12 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.195 -1.585 . . . . 0.0 115.123 0.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.514 HG23 ' N ' ' A' ' 26' ' ' CYS . 30.2 mt -105.53 148.97 9.32 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 CA-C-O 121.179 0.514 . . . . 0.0 112.113 -178.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.514 ' N ' HG23 ' A' ' 25' ' ' ILE . 76.1 m -87.85 132.18 34.28 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 121.773 -0.579 . . . . 0.0 110.271 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.545 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.1 mtm -129.87 141.82 50.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.492 0.663 . . . . 0.0 110.999 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 4.3 ttpt -99.02 106.76 19.04 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.845 178.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.005 -179.185 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.75 115.13 63.1 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 117.165 0.483 . . . . 0.0 111.002 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.528 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.9 Cg_endo -79.19 39.63 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.768 2.312 . . . . 0.0 112.302 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -85.03 24.16 1.12 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.534 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 82.7 m -89.71 -32.88 16.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.685 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.79 40.77 89.66 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.251 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.571 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.6 tt0 -140.4 150.34 43.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.417 HG23 ' O ' ' A' ' 24' ' ' PRO . 18.1 m -121.42 109.64 15.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.286 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 10.8 p -88.83 62.34 6.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.4 p -57.74 -35.47 70.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.02 0.438 . . . . 0.0 110.617 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.7 mt -81.29 -20.07 41.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.954 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.42 40.26 3.25 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.08 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 29.7 m -157.75 129.28 6.8 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 122.219 0.208 . . . . 0.0 110.498 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.571 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 26.7 m -113.56 123.35 49.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -81.43 -23.0 37.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 19' ' ' CYS . 59.9 t -58.78 127.29 82.58 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.734 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.31 128.3 29.44 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.369 2.712 . . . . 0.0 114.288 -178.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.472 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 19.1 t0 64.99 6.77 3.6 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.581 -1.19 . . . . 0.0 113.307 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 16' ' ' VAL . 16.0 m -88.71 126.24 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.612 -0.68 . . . . 0.0 111.262 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.67 140.23 29.96 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.684 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.7 t -74.77 114.2 12.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.051 0.453 . . . . 0.0 110.629 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -114.51 49.98 0.99 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.14 129.14 0.04 OUTLIER Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 113.139 -1.846 . . . . 0.0 114.486 -176.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.417 ' O ' HG23 ' A' ' 8' ' ' THR . 83.3 Cg_endo -80.63 -18.71 24.09 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 C-N-CA 122.893 -1.711 . . . . 0.0 115.016 0.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.448 HD12 HG23 ' A' ' 25' ' ' ILE . 26.3 mt -91.98 147.72 5.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -87.18 134.34 33.54 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -131.49 143.12 50.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.346 0.593 . . . . 0.0 111.307 -179.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.491 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.48 103.81 13.36 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.313 -178.507 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.358 -0.134 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.86 115.25 63.44 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 117.075 0.437 . . . . 0.0 110.918 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.546 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 79.4 Cg_endo -79.22 39.55 0.83 Allowed 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.735 2.29 . . . . 0.0 112.38 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.6 p -85.48 25.86 0.99 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.427 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.5 m -89.74 -32.94 16.76 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.925 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.84 41.55 82.29 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.18 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.577 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.7 tt0 -142.18 155.01 45.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.432 HG23 HG23 ' A' ' 10' ' ' THR . 25.0 m -126.89 110.11 12.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.33 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.5 p -88.93 62.89 6.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.301 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.432 HG23 HG23 ' A' ' 8' ' ' THR . 1.4 p -58.01 -35.77 71.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.004 0.431 . . . . 0.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -81.18 -20.14 41.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.952 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.29 39.78 3.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 24.1 m -157.66 129.1 6.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 122.238 0.215 . . . . 0.0 110.599 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.577 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 29.7 m -112.65 123.52 50.49 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -81.34 -23.55 37.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.592 HG11 ' SG ' ' A' ' 19' ' ' CYS . 62.5 t -58.23 126.74 79.06 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.686 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.73 129.41 34.88 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.344 2.696 . . . . 0.0 114.338 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.469 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 18.6 t0 65.3 5.09 2.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.559 -1.201 . . . . 0.0 113.429 178.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.592 ' SG ' HG11 ' A' ' 16' ' ' VAL . 14.3 m -88.3 126.78 35.35 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.55 -0.719 . . . . 0.0 111.29 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.7 140.07 30.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.704 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.7 115.66 14.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.035 0.445 . . . . 0.0 110.712 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 62.4 m -116.07 49.98 1.07 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 178.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 50.5 t90 -17.77 128.76 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 113.059 -1.882 . . . . 0.0 114.51 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -81.27 -18.85 23.95 Favored 'Cis proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.889 -1.713 . . . . 0.0 114.866 0.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.467 HG21 ' N ' ' A' ' 26' ' ' CYS . 26.5 mt -90.75 147.87 4.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.467 ' N ' HG21 ' A' ' 25' ' ' ILE . 64.0 m -88.02 134.45 33.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.8 mtt -130.88 142.8 50.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.311 0.577 . . . . 0.0 111.419 -179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.469 ' HZ3' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER -107.1 103.41 12.81 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 177.995 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.315 -178.435 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-O 120.36 -0.133 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.405 HD11 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.73 115.11 63.06 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 117.107 0.454 . . . . 0.0 110.9 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.477 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.5 Cg_endo -79.22 40.12 0.9 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.716 2.277 . . . . 0.0 112.405 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.1 p -85.78 23.14 1.48 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.472 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.0 m -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.84 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.45 38.25 79.76 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -139.98 148.84 42.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -120.99 114.2 21.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.31 0.576 . . . . 0.0 110.002 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.2 p -89.6 60.17 5.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.285 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.2 p -57.64 -35.81 71.0 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.119 0.485 . . . . 0.0 110.379 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.0 mt -81.62 -21.08 38.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.918 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.35 41.58 2.54 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.199 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.5 m -157.96 133.77 9.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.242 0.217 . . . . 0.0 110.468 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.4 m -118.59 121.06 39.3 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -81.19 -25.64 36.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.346 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.4 t -60.3 124.29 77.24 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-O 121.067 0.46 . . . . 0.0 110.422 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -45.65 126.37 8.77 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.824 3.016 . . . . 0.0 114.691 -178.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.459 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 20.2 t0 63.64 8.89 3.94 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.511 178.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -88.33 126.49 35.22 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.374 -0.829 . . . . 0.0 111.175 179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.5 m -90.21 144.41 25.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.797 -179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -76.65 111.94 12.69 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.028 0.442 . . . . 0.0 110.977 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.564 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.9 m -112.96 50.65 0.87 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -20.69 130.44 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.304 0 CA-C-N 113.277 -1.783 . . . . 0.0 114.284 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -82.57 -6.95 48.12 Favored 'Cis proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.094 -1.628 . . . . 0.0 115.086 0.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.559 HG23 ' N ' ' A' ' 26' ' ' CYS . 29.3 mt -103.4 148.55 8.27 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 CA-C-O 121.258 0.551 . . . . 0.0 112.381 -177.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.559 ' N ' HG23 ' A' ' 25' ' ' ILE . 72.0 m -86.55 133.61 33.71 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 121.86 -0.525 . . . . 0.0 109.889 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -134.03 142.92 47.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 111.249 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -105.37 104.24 13.92 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.406 -178.486 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.395 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.155 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.72 115.94 65.12 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 117.074 0.437 . . . . 0.0 110.793 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.418 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.1 Cg_endo -78.69 40.34 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.688 2.259 . . . . 0.0 112.57 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.4 p -84.66 31.85 0.52 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.285 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.67 -35.39 9.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.922 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 38.54 84.82 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.234 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.636 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.0 tt0 -139.46 148.99 43.48 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 t -120.88 114.44 21.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.421 0.629 . . . . 0.0 109.871 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.7 p -89.58 60.47 5.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.268 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -57.46 -36.12 71.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.107 0.48 . . . . 0.0 110.452 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.24 -20.85 36.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.925 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.42 42.12 2.42 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.291 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 36.0 m -157.52 134.32 10.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.421 -0.215 . . . . 0.0 110.421 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.636 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.2 m -119.89 120.85 37.62 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.38 -25.4 36.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.302 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.629 HG11 ' SG ' ' A' ' 19' ' ' CYS . 98.3 t -60.15 125.1 80.38 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.072 0.463 . . . . 0.0 110.429 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.96 125.31 6.56 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 123.903 3.068 . . . . 0.0 114.779 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.451 ' CG ' ' HZ3' ' A' ' 28' ' ' LYS . 20.1 t0 62.55 10.76 4.27 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.551 177.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' HG11 ' A' ' 16' ' ' VAL . 16.9 m -88.5 125.97 35.02 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.271 -0.893 . . . . 0.0 111.047 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 m -89.96 144.68 25.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.8 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -76.14 111.17 11.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.006 0.432 . . . . 0.0 110.901 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.558 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.5 m -111.96 50.29 0.86 Allowed 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -20.5 130.35 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.333 0 CA-C-N 113.259 -1.791 . . . . 0.0 114.274 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.52 -6.96 47.99 Favored 'Cis proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.129 0.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.43 HG22 HD12 ' A' ' 25' ' ' ILE . 29.6 mt -103.1 148.7 7.88 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-O 121.26 0.552 . . . . 0.0 112.318 -178.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.403 ' N ' HG21 ' A' ' 25' ' ' ILE . 74.5 m -86.59 133.55 33.71 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.857 -0.527 . . . . 0.0 109.966 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.558 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -135.17 144.77 47.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.276 0.56 . . . . 0.0 111.19 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.23 103.47 12.94 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.144 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.408 -178.701 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.434 0 CA-C-O 120.339 -0.145 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.58 112.86 59.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 117.128 0.464 . . . . 0.0 110.895 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.45 40.67 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.687 2.258 . . . . 0.0 112.609 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -96.91 34.41 1.72 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 28' ' ' LYS . 57.6 m -101.72 -38.26 7.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.91 37.28 56.89 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.549 ' OE1' ' HB3' ' A' ' 14' ' ' CYS . 55.0 tt0 -133.54 152.75 51.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.63 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.4 p -128.69 115.1 17.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.251 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.531 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.7 p -89.22 61.43 5.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.053 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.1 -36.85 71.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.938 0.399 . . . . 0.0 110.548 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.4 mt -83.78 -18.31 38.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.756 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.32 41.14 2.84 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.151 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.1 m -156.45 133.19 10.26 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.874 -0.191 . . . . 0.0 110.854 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB3' ' OE1' ' A' ' 7' ' ' GLU . 31.8 m -121.97 119.41 31.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.3 p90 -81.91 -20.24 39.16 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.487 -178.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.64 HG12 ' SG ' ' A' ' 19' ' ' CYS . 49.2 t -64.55 121.41 72.72 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.222 0.534 . . . . 0.0 110.818 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.74 133.43 44.75 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.434 2.756 . . . . 0.0 113.681 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.589 ' HB3' ' HD2' ' A' ' 28' ' ' LYS . 29.7 t70 71.52 -5.18 1.68 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.347 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.64 ' SG ' HG12 ' A' ' 16' ' ' VAL . 62.2 m -88.2 129.3 35.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.569 0.699 . . . . 0.0 110.915 179.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m -100.27 148.78 24.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.818 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.456 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.4 t -75.03 116.57 15.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.931 0.396 . . . . 0.0 110.823 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.519 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 50.5 m -121.0 49.48 1.48 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 50.8 t90 -19.29 129.92 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.4 0 O-C-N 125.569 1.793 . . . . 0.0 114.459 -177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -81.84 -13.68 36.73 Favored 'Cis proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.174 -1.594 . . . . 0.0 114.827 0.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.406 HG22 HD11 ' A' ' 25' ' ' ILE . 30.3 mt -94.63 150.02 4.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 121.214 0.531 . . . . 0.0 112.25 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.8 m -92.78 128.5 38.66 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 121.798 -0.564 . . . . 0.0 110.337 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.519 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 53.4 mtt -118.49 135.07 54.59 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.589 ' HD2' ' HB3' ' A' ' 18' ' ' ASP . 10.4 ttpp -89.19 99.81 12.72 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.432 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.344 -178.797 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 120.406 -0.108 . . . . 0.0 113.102 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.54 64.1 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.949 0.375 . . . . 0.0 110.885 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 83.1 Cg_endo -79.02 40.39 0.93 Allowed 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.748 2.299 . . . . 0.0 112.418 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -85.57 23.26 1.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.489 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.8 m -89.75 -33.76 16.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.08 39.29 73.39 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.403 ' OE1' HG23 ' A' ' 16' ' ' VAL . 59.6 tt0 -140.87 149.5 42.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.078 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -122.56 112.68 18.3 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.815 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.451 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.6 p -88.61 60.93 5.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.314 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.6 p -58.09 -35.08 70.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.997 0.427 . . . . 0.0 110.337 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.4 mt -82.08 -21.14 36.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.938 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.04 40.84 2.75 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.191 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.3 m -157.68 133.06 8.95 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.214 0.205 . . . . 0.0 110.477 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.3 m -118.17 119.98 36.35 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -81.38 -21.01 39.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.218 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.403 HG23 ' OE1' ' A' ' 7' ' ' GLU . 61.7 t -62.38 128.39 91.23 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -51.27 125.37 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 123.437 2.758 . . . . 0.0 114.25 -177.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.8 t0 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.484 -1.235 . . . . 0.0 113.082 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -89.2 126.63 35.57 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 111.114 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.9 m -90.41 143.43 26.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.908 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.0 t -75.98 109.66 9.79 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.048 0.451 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.567 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.7 m -111.38 50.47 0.83 Allowed 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -20.79 130.48 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.321 -176.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.57 -2.76 55.04 Favored 'Cis proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.242 -1.566 . . . . 0.0 115.066 0.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.7 mt -106.73 148.44 11.09 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 CA-C-O 121.215 0.531 . . . . 0.0 112.147 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.62 133.43 33.81 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 121.818 -0.551 . . . . 0.0 110.082 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.567 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.2 mtt -133.2 145.17 50.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 111.291 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.484 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.763 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.043 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.43 115.94 65.04 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 117.102 0.451 . . . . 0.0 110.92 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.6 Cg_endo -79.26 40.17 0.91 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.72 2.28 . . . . 0.0 112.451 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -84.59 22.36 1.32 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.575 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 65.1 m -89.66 -34.57 16.22 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.713 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 39.08 85.37 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.422 ' OE1' HG23 ' A' ' 16' ' ' VAL . 68.3 tt0 -135.89 150.82 49.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.264 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.9 108.17 13.13 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.814 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 13.6 p -89.04 61.52 5.89 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.346 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.468 HG23 HG22 ' A' ' 8' ' ' THR . 1.2 p -57.69 -35.56 70.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.044 0.449 . . . . 0.0 110.544 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -81.68 -20.23 39.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.037 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.83 41.26 2.92 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.114 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.6 m -156.11 132.55 10.16 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.9 m -118.3 120.11 36.64 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -81.18 -20.75 40.53 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.126 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.422 HG23 ' OE1' ' A' ' 7' ' ' GLU . 57.5 t -62.18 128.49 91.06 Favored Pre-proline 0 C--O 1.234 0.259 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -50.28 124.2 12.55 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 123.527 2.818 . . . . 0.0 114.342 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 63.04 13.33 6.66 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.448 -1.251 . . . . 0.0 113.084 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.0 m -89.5 126.98 35.8 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.262 -0.899 . . . . 0.0 111.254 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -90.04 143.73 26.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.607 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.7 t -78.09 105.5 9.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.915 0.388 . . . . 0.0 111.004 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.566 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.7 m -104.85 50.77 0.78 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.0 t90 -19.74 129.31 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 O-C-N 125.511 1.757 . . . . 0.0 114.351 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.37 -15.99 30.9 Favored 'Cis proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.905 -1.706 . . . . 0.0 115.06 0.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.5 mt -92.95 146.99 5.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 CA-C-O 121.535 0.683 . . . . 0.0 112.764 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.1 m -86.54 134.14 33.68 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.566 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.7 mtt -133.35 143.83 49.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 111.415 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.762 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 177.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 120.372 -0.127 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.62 114.7 61.59 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 117.14 0.47 . . . . 0.0 110.923 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 87.1 Cg_endo -79.61 40.27 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.716 2.278 . . . . 0.0 112.48 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.8 p -84.73 20.63 1.73 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.492 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.4 m -89.61 -35.8 15.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.808 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.52 37.89 90.15 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.512 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.64 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 20.2 tt0 -133.95 148.62 51.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' THR . 13.5 m -116.75 108.66 16.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.105 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 13' ' ' THR . 11.3 p -89.06 61.63 5.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.488 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.55 -36.14 71.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 0.0 110.598 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.67 -17.7 40.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.14 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.04 42.85 2.95 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.038 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.412 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 39.4 m -155.46 134.75 12.35 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.64 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 47.2 m -121.66 121.28 37.0 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -81.22 -24.42 37.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.233 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.572 HG23 ' OE1' ' A' ' 7' ' ' GLU . 97.1 t -60.55 125.87 83.46 Favored Pre-proline 0 C--O 1.233 0.225 0 CA-C-O 121.02 0.438 . . . . 0.0 110.373 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -43.69 123.61 3.93 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 123.958 3.106 . . . . 0.0 114.93 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.3 t0 60.94 13.58 4.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.463 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 m -88.71 125.44 34.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 121.327 -0.858 . . . . 0.0 111.308 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 m -89.97 142.26 27.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.521 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -74.8 115.23 14.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.408 . . . . 0.0 110.834 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.0 m -115.21 49.14 1.09 Allowed 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -17.64 129.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.318 0 CA-C-N 113.021 -1.899 . . . . 0.0 114.605 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.55 -18.54 24.47 Favored 'Cis proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.885 -1.714 . . . . 0.0 114.934 -0.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.7 mt -91.95 147.96 4.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.29 134.96 33.71 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.2 mtt -134.6 141.27 46.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.307 0.575 . . . . 0.0 111.217 -179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.32 -0.682 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.69 115.31 63.53 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 117.171 0.486 . . . . 0.0 110.782 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.428 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.4 Cg_endo -78.75 40.32 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.775 2.317 . . . . 0.0 112.687 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.1 p -84.7 27.92 0.7 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.382 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.6 m -96.68 -35.2 11.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.24 38.03 87.24 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.631 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -138.68 146.43 41.59 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.8 p -116.97 112.3 20.8 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.087 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.3 p -88.83 61.12 5.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.277 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.1 p -58.29 -35.09 71.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.068 0.461 . . . . 0.0 110.386 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.95 -21.02 34.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.005 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.95 42.51 2.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.253 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.407 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 37.2 m -157.6 135.15 10.51 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.631 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 55.6 m -121.13 120.97 36.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.5 -25.61 35.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.428 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.597 HG23 ' OE1' ' A' ' 7' ' ' GLU . 85.6 t -60.45 127.39 86.54 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.049 0.452 . . . . 0.0 110.44 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -43.43 123.4 3.57 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 124.021 3.147 . . . . 0.0 114.955 -178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.71 16.86 5.82 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.517 -1.219 . . . . 0.0 113.286 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.0 m -89.27 125.24 35.01 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.19 -0.944 . . . . 0.0 111.036 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -89.87 142.64 27.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.519 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -75.2 110.84 9.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.067 0.46 . . . . 0.0 111.07 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.564 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.7 m -111.97 49.79 0.89 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.9 t90 -19.87 130.57 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 CA-C-N 113.172 -1.831 . . . . 0.0 114.356 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.36 -2.9 54.31 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.227 -1.572 . . . . 0.0 115.139 0.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -107.25 148.35 11.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 CA-C-O 121.253 0.549 . . . . 0.0 112.08 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.41 134.27 33.72 Favored 'General case' 0 C--N 1.317 -0.837 0 O-C-N 121.798 -0.564 . . . . 0.0 110.254 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -134.92 143.72 47.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.214 0.531 . . . . 0.0 111.047 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.67 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.5 63.99 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 117.033 0.416 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -78.93 39.97 0.87 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.3 p -84.49 23.82 1.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.519 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 85.2 m -89.65 -33.59 16.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.601 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.23 37.57 86.77 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.521 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.637 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -135.1 147.53 49.56 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' THR . 14.8 m -117.4 108.37 15.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.005 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.3 p -88.89 61.5 5.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.382 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.496 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.89 -35.5 71.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.052 0.453 . . . . 0.0 110.455 178.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.68 -19.81 40.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.02 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.36 41.24 3.03 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.181 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.9 m -156.7 132.95 9.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.637 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 45.7 m -117.44 122.24 43.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -81.1 -24.68 37.54 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.123 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.581 HG23 ' OE1' ' A' ' 7' ' ' GLU . 92.0 t -60.25 127.61 86.46 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.55 127.92 26.09 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.352 2.701 . . . . 0.0 114.225 -177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.8 t0 65.23 9.08 5.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.148 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.8 m -89.11 125.49 35.05 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.444 -0.785 . . . . 0.0 111.261 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.8 m -90.25 141.19 28.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.722 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -75.94 112.57 12.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.002 0.429 . . . . 0.0 110.704 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.6 m -112.86 50.19 0.89 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 48.8 t90 -17.98 129.14 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.786 1.929 . . . . 0.0 114.539 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.475 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 90.0 Cg_endo -81.29 -16.88 28.81 Favored 'Cis proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.97 -1.679 . . . . 0.0 114.921 -0.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -93.13 147.88 5.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -86.87 134.92 33.49 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.0 mtt -131.13 144.47 51.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.291 0.567 . . . . 0.0 111.281 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 CA-C-O 120.399 -0.112 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.71 115.63 64.33 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 117.048 0.424 . . . . 0.0 110.885 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -79.27 41.25 1.06 Allowed 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.789 2.326 . . . . 0.0 112.401 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.9 p -84.08 22.04 1.26 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.476 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 66.7 m -89.75 -34.72 16.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.741 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.47 37.26 89.86 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.507 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.641 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.5 tt0 -134.2 147.79 50.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.489 HG22 HG23 ' A' ' 10' ' ' THR . 13.8 m -116.98 108.36 15.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.026 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.9 p -88.94 61.25 5.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.381 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.489 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.98 -35.4 71.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.063 0.458 . . . . 0.0 110.449 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.9 mt -81.86 -20.15 39.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.998 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.69 41.77 2.84 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.197 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.424 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 27.9 m -156.76 133.52 10.2 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.641 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.4 m -118.74 122.14 41.75 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -81.06 -24.86 37.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.607 HG23 ' OE1' ' A' ' 7' ' ' GLU . 99.2 t -59.74 128.17 86.17 Favored Pre-proline 0 C--O 1.233 0.221 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -51.68 126.89 20.99 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.542 2.828 . . . . 0.0 114.254 -177.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.0 t0 64.17 11.13 6.03 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 114.499 -1.228 . . . . 0.0 113.059 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 m -89.18 124.9 34.78 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.344 -0.848 . . . . 0.0 111.259 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -89.98 141.23 28.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.621 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.6 t -75.56 112.18 11.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.572 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 54.2 m -111.87 49.78 0.88 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -18.06 129.3 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 113.048 -1.887 . . . . 0.0 114.499 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.02 -17.22 27.96 Favored 'Cis proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.986 -1.673 . . . . 0.0 114.871 -0.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.4 mt -92.81 147.8 5.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.5 m -86.43 134.78 33.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.1 mtt -132.82 144.26 50.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.368 0.604 . . . . 0.0 111.249 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.721 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.338 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -93.48 118.25 67.53 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 117.222 0.511 . . . . 0.0 110.675 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -74.68 38.84 0.53 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.744 2.296 . . . . 0.0 112.924 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -81.73 52.42 1.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.007 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.5 m -140.06 -43.32 0.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.235 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.32 35.21 76.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.379 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.615 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 19.3 tt0 -121.92 149.3 43.62 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 HG23 ' A' ' 10' ' ' THR . 11.0 m -115.51 107.37 15.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.934 0.397 . . . . 0.0 110.366 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.404 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.3 p -89.17 61.39 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.207 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.518 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.39 -35.94 70.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.012 0.434 . . . . 0.0 110.577 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.13 -17.79 41.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.83 41.96 3.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.883 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.404 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.0 m -156.13 134.23 11.33 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.313 0.245 . . . . 0.0 110.353 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 36.4 m -118.9 121.02 39.01 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -81.06 -25.26 37.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.063 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.47 HG23 ' OE1' ' A' ' 7' ' ' GLU . 87.5 t -62.76 125.94 87.48 Favored Pre-proline 0 C--O 1.235 0.309 0 CA-C-O 121.028 0.442 . . . . 0.0 109.952 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.23 138.09 64.7 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.711 2.274 . . . . 0.0 112.831 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 33.2 t0 65.65 45.76 2.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.431 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.41 127.25 17.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.688 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -99.79 145.25 27.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.329 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -71.98 117.64 13.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.001 0.429 . . . . 0.0 110.671 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.537 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.2 m -117.93 47.1 1.63 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -16.47 129.06 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.773 1.921 . . . . 0.0 114.718 -176.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -79.55 -21.04 18.33 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.89 -1.713 . . . . 0.0 114.962 -0.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -90.38 148.35 4.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.605 0 CA-C-O 121.452 0.644 . . . . 0.0 112.579 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.4 m -86.24 131.08 34.31 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 121.944 -0.472 . . . . 0.0 109.729 178.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.537 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.4 mtm -134.43 142.53 47.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.353 0.597 . . . . 0.0 111.196 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt . . . . . 0 C--N 1.317 -0.842 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.871 178.289 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 CA-C-O 120.351 -0.138 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.56 114.46 60.63 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 117.124 0.462 . . . . 0.0 110.724 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.3 Cg_endo -76.29 37.89 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.662 2.241 . . . . 0.0 112.756 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -86.7 40.1 0.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.124 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.7 m -108.87 -34.55 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.665 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.7 41.4 56.7 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.627 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.8 tt0 -143.99 147.28 33.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.8 p -119.37 111.78 18.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.85 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 14.3 p -88.55 61.72 6.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.439 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.37 -34.0 70.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 110.43 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.4 mt -80.45 -22.22 41.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.948 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.13 39.07 3.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.273 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 23.0 m -158.9 130.91 6.6 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 122.296 0.238 . . . . 0.0 110.391 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.627 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 58.2 m -111.85 121.78 45.99 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -81.25 -25.75 36.36 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.501 HG23 ' OE1' ' A' ' 7' ' ' GLU . 74.5 t -62.19 124.35 81.9 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 121.073 0.463 . . . . 0.0 109.911 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.85 138.69 64.52 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.642 2.228 . . . . 0.0 112.618 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.5 t0 66.85 45.55 1.84 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.403 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.8 m -145.02 130.38 18.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m -97.61 148.63 23.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.523 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -79.75 103.79 9.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.936 0.398 . . . . 0.0 111.056 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.561 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.0 m -104.23 52.17 0.76 Allowed 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 178.004 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 58.5 t90 -22.01 130.3 0.07 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 125.278 1.611 . . . . 0.0 114.142 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -84.75 1.57 62.25 Favored 'Cis proline' 0 C--N 1.346 0.405 0 C-N-CA 123.235 -1.569 . . . . 0.0 115.134 0.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.6 mt -110.5 146.84 15.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 112.182 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.7 m -85.43 132.44 34.22 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 121.805 -0.559 . . . . 0.0 110.161 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.1 mtt -133.43 144.54 49.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.173 0.511 . . . . 0.0 111.057 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt . . . . . 0 C--N 1.318 -0.774 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.016 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -92.73 116.44 66.5 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 117.196 0.498 . . . . 0.0 110.936 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -78.86 40.25 0.91 Allowed 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.776 2.318 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.6 p -85.79 21.93 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.467 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.4 m -89.65 -34.49 16.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.63 37.51 89.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.193 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -138.24 146.68 42.87 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -117.12 112.53 21.0 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.9 p -88.81 60.65 5.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.9 p -58.15 -35.02 70.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.004 0.43 . . . . 0.0 110.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -20.56 34.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.976 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.55 42.16 2.58 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.213 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.4 m -157.93 134.91 9.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.9 m -120.33 120.92 37.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -81.25 -25.67 36.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.492 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.587 HG23 ' OE1' ' A' ' 7' ' ' GLU . 89.2 t -60.37 126.97 85.76 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 121.022 0.439 . . . . 0.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -43.55 123.93 3.96 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.957 3.104 . . . . 0.0 114.869 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 60.27 15.87 5.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.399 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.3 m -89.24 124.81 34.72 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 121.185 -0.947 . . . . 0.0 110.973 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m -89.79 141.48 28.58 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.617 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -73.97 114.47 12.33 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.16 0.505 . . . . 0.0 110.942 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.7 m -115.52 48.54 1.18 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.47 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 51.3 t90 -18.94 130.01 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 125.553 1.783 . . . . 0.0 114.443 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 97.2 Cg_endo -82.97 -5.03 51.29 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.168 -1.597 . . . . 0.0 115.15 0.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mt -105.39 149.0 9.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 CA-C-O 121.144 0.497 . . . . 0.0 112.097 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 68.3 m -88.07 133.39 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.737 -0.602 . . . . 0.0 110.347 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -132.97 142.15 48.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.282 0.563 . . . . 0.0 111.205 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.786 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 120.501 -0.055 . . . . 0.0 113.083 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.56 115.84 65.28 Favored Pre-proline 0 C--N 1.328 -0.341 0 O-C-N 122.492 -0.417 . . . . 0.0 110.699 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 27' ' ' MET . 74.5 Cg_endo -75.86 36.97 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.624 2.216 . . . . 0.0 112.555 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -86.18 42.05 0.97 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.7 m -111.45 -35.49 5.8 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.482 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.0 42.21 69.17 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.429 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -138.55 151.49 47.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.841 0.353 . . . . 0.0 110.465 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.479 HG22 HG23 ' A' ' 10' ' ' THR . 18.7 m -122.42 109.08 13.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.729 -0.668 . . . . 0.0 109.57 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.5 p -88.81 61.57 6.03 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.423 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.479 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.86 71.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.096 0.474 . . . . 0.0 110.452 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.3 mt -81.84 -20.94 37.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.986 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.79 41.38 2.69 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.001 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 54.2 m -156.46 134.32 11.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 45.3 m -120.22 119.08 32.19 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -81.61 -20.53 39.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.955 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.38 129.61 92.58 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.829 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -47.71 134.0 22.0 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 123.71 2.94 . . . . 0.0 113.967 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.586 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 44.79 34.08 1.11 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.334 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.7 m -108.45 128.33 54.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.172 0.511 . . . . 0.0 110.561 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -92.46 143.92 25.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.871 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.0 t -75.19 110.72 9.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.947 0.403 . . . . 0.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 52.0 m -111.52 49.78 0.87 Allowed 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.68 128.65 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.256 0 O-C-N 125.651 1.844 . . . . 0.0 114.451 -176.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -81.22 -19.4 22.58 Favored 'Cis proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.783 -1.757 . . . . 0.0 114.836 -0.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.2 mt -88.67 148.03 4.82 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-O 121.441 0.639 . . . . 0.0 112.713 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.2 m -89.42 132.84 34.8 Favored 'General case' 0 C--N 1.318 -0.764 0 O-C-N 122.017 -0.427 . . . . 0.0 109.945 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.7 mtt -128.14 141.84 51.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 110.754 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 8.3 ttpt . . . . . 0 C--N 1.316 -0.887 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 CA-C-O 120.418 -0.101 . . . . 0.0 113.17 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.74 115.6 64.27 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 117.133 0.466 . . . . 0.0 110.859 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.6 Cg_endo -78.89 40.57 0.95 Allowed 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.699 2.266 . . . . 0.0 112.591 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.3 p -85.07 29.92 0.62 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.358 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.4 m -99.36 -35.36 9.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.969 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.85 38.72 75.99 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -138.79 151.92 47.46 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.079 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 t -125.08 114.51 19.16 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.44 0.638 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.4 p -89.5 60.73 5.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.263 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.19 -36.43 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.078 0.466 . . . . 0.0 110.497 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.73 -19.8 37.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.96 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.46 41.98 2.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.235 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.5 m -156.97 134.13 10.43 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.5 m -120.46 119.15 32.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -81.46 -20.72 39.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.327 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.7 t -63.23 126.25 88.8 Favored Pre-proline 0 C--O 1.233 0.233 0 CA-C-O 121.0 0.429 . . . . 0.0 110.349 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -43.99 122.53 3.56 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.946 3.098 . . . . 0.0 114.842 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.2 t0 61.48 13.19 4.9 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.4 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 21.2 m -88.74 127.39 35.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.356 -0.84 . . . . 0.0 111.089 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -91.02 144.08 26.03 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.872 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.403 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.1 t -75.06 111.14 9.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.045 0.45 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 57.5 m -112.54 50.07 0.89 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.7 t90 -20.57 130.1 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 113.321 -1.763 . . . . 0.0 114.297 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.46 -8.6 45.95 Favored 'Cis proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.042 0.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.1 mt -100.76 148.74 6.67 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.72 133.17 33.9 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 121.822 -0.548 . . . . 0.0 109.764 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 48.1 mtt -134.89 145.66 48.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.255 0.55 . . . . 0.0 111.314 -178.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.725 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 120.325 -0.153 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -97.53 119.56 62.5 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 117.157 0.479 . . . . 0.0 110.567 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.24 36.07 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.703 2.269 . . . . 0.0 112.738 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -84.77 49.34 1.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.831 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 58.6 m -125.29 -37.72 2.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.552 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.34 42.18 75.46 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.519 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -135.81 152.16 50.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.889 0.376 . . . . 0.0 110.27 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.48 HG22 HG23 ' A' ' 10' ' ' THR . 18.3 m -122.66 109.98 14.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.744 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.1 p -88.97 61.61 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.331 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.48 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.55 -36.49 71.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.7 mt -82.72 -19.26 38.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.095 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 42.0 2.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.02 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.0 m -156.17 135.18 11.98 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 38.4 m -121.95 118.69 29.46 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -81.67 -20.46 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.178 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 99.1 t -64.02 128.34 92.89 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.504 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_exo -40.68 129.79 2.67 Favored 'Trans proline' 0 C--O 1.237 0.449 0 C-N-CA 124.077 3.185 . . . . 0.0 114.719 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.538 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 43.76 30.78 0.4 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.76 179.257 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 m -101.29 125.65 47.94 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.197 0.523 . . . . 0.0 110.408 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 m -90.04 143.49 26.73 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.851 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.2 t -72.99 114.91 11.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.959 0.409 . . . . 0.0 110.664 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.534 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 67.6 m -115.31 48.0 1.24 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.3 t90 -17.99 128.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 125.647 1.842 . . . . 0.0 114.434 -176.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -80.34 -22.57 15.68 Favored 'Cis proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.737 -1.776 . . . . 0.0 114.82 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.9 148.83 4.47 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 CA-C-O 121.454 0.645 . . . . 0.0 112.666 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.4 m -90.41 131.73 36.01 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.886 -0.509 . . . . 0.0 110.004 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 43.6 mtm -129.6 140.1 51.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.431 0.634 . . . . 0.0 110.692 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 11.6 ttpt . . . . . 0 C--N 1.314 -0.959 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.939 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-O 120.277 -0.18 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 113.74 58.14 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 117.273 0.536 . . . . 0.0 110.929 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.438 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.1 Cg_endo -76.48 38.59 0.62 Allowed 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.708 2.272 . . . . 0.0 112.837 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -89.85 35.8 0.85 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.29 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.0 m -102.73 -34.55 8.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.72 40.49 65.37 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.703 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.613 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.9 tt0 -142.04 147.42 36.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.9 p -118.71 112.75 20.17 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.136 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.416 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.6 p -88.7 62.34 6.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.246 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -58.27 -35.01 71.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.069 0.461 . . . . 0.0 110.493 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.6 mt -83.12 -17.66 42.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.025 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.44 40.64 3.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.068 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 22.9 m -157.77 132.3 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.352 0.261 . . . . 0.0 110.353 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.613 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 56.0 m -115.47 120.25 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.9 p90 -81.14 -26.14 36.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.076 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 71.5 t -62.27 118.92 44.72 Favored Pre-proline 0 C--O 1.235 0.296 0 CA-C-O 121.146 0.498 . . . . 0.0 110.513 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -56.0 137.87 80.52 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.116 2.544 . . . . 0.0 112.805 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 42.1 t0 66.12 45.12 2.43 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.498 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 38.9 m -143.92 130.55 20.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.224 0.535 . . . . 0.0 110.81 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.0 m -99.85 146.95 26.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.637 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.55 115.34 16.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.033 0.444 . . . . 0.0 110.959 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -117.47 50.39 1.12 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -19.94 130.72 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.417 0 CA-C-N 113.21 -1.814 . . . . 0.0 114.4 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.03 -4.31 52.11 Favored 'Cis proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.266 -1.556 . . . . 0.0 115.074 0.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 32.2 mt -106.26 148.7 10.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 CA-C-O 121.265 0.555 . . . . 0.0 112.156 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.24 134.61 33.52 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.865 -0.522 . . . . 0.0 110.254 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.9 mtt -132.07 143.04 49.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.24 0.543 . . . . 0.0 111.019 -179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 ttpt . . . . . 0 C--N 1.318 -0.78 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.208 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -94.07 117.19 67.14 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 117.2 0.5 . . . . 0.0 110.916 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.59 40.48 0.92 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.883 2.389 . . . . 0.0 112.413 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.9 p -86.61 22.7 1.83 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.498 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.1 m -89.62 -34.12 16.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.833 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.4 38.82 70.28 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -139.93 152.53 46.45 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.078 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.3 t -126.29 114.84 18.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.453 0.644 . . . . 0.0 109.759 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.45 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 10.3 p -89.49 60.75 5.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.212 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.0 p -57.24 -36.31 70.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.152 0.501 . . . . 0.0 110.428 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.93 -19.13 41.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.982 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.66 40.5 3.14 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.038 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.2 m -157.51 132.7 8.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 122.17 0.188 . . . . 0.0 110.524 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 53.6 m -117.12 120.26 37.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -81.41 -20.64 39.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.167 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.69 126.67 88.97 Favored Pre-proline 0 C--O 1.233 0.2 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -53.16 127.61 25.78 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.322 2.682 . . . . 0.0 114.013 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.9 t0 66.97 5.48 4.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.604 -1.18 . . . . 0.0 113.134 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.9 m -88.39 129.01 35.52 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 121.488 -0.757 . . . . 0.0 111.186 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.31 143.45 26.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.056 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.445 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t -74.51 115.4 14.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.065 0.46 . . . . 0.0 110.798 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.583 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 60.8 m -117.28 49.51 1.19 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -20.04 129.72 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 125.46 1.725 . . . . 0.0 114.255 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.78 -11.97 40.09 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.105 -1.623 . . . . 0.0 115.174 0.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 31.1 mt -98.24 149.82 5.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.62 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.42 132.27 35.08 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.712 -0.617 . . . . 0.0 109.775 178.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.583 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -131.44 144.21 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.455 0.645 . . . . 0.0 111.539 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-O 120.276 -0.18 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -95.16 116.63 66.52 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 117.237 0.518 . . . . 0.0 110.813 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.43 38.19 0.54 Allowed 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.736 2.291 . . . . 0.0 112.871 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -88.69 40.47 0.97 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.232 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 76.1 m -110.95 -34.57 6.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.694 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.33 42.07 66.48 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.995 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.3 tt0 -143.02 147.42 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.6 p -118.76 112.46 19.77 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.067 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.408 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.68 62.06 6.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.162 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.19 -34.7 70.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.088 0.471 . . . . 0.0 110.509 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.1 mt -82.73 -19.2 38.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.91 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.88 40.26 3.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.093 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.4 m -158.29 132.01 7.75 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 122.346 0.258 . . . . 0.0 110.363 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.622 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.7 m -113.89 121.45 44.0 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -81.1 -25.26 37.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.983 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 75.7 t -62.5 124.69 83.8 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.065 0.459 . . . . 0.0 109.834 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.53 138.17 63.59 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.644 2.23 . . . . 0.0 112.746 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 20.1 t0 66.59 44.52 2.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.592 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 m -143.03 130.55 21.19 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.612 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -99.29 145.8 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.864 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.93 116.22 15.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.047 0.451 . . . . 0.0 110.678 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 65.4 m -117.92 49.45 1.24 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -19.25 130.08 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 114.428 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.96 -5.16 51.12 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.195 -1.585 . . . . 0.0 115.123 0.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.2 mt -105.53 148.97 9.32 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 CA-C-O 121.179 0.514 . . . . 0.0 112.113 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.1 m -87.85 132.18 34.28 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 121.773 -0.579 . . . . 0.0 110.271 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.1 mtm -129.87 141.82 50.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.492 0.663 . . . . 0.0 110.999 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 4.3 ttpt . . . . . 0 C--N 1.317 -0.818 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.845 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.75 115.13 63.1 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 117.165 0.483 . . . . 0.0 111.002 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.518 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.9 Cg_endo -79.19 39.63 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.768 2.312 . . . . 0.0 112.302 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -85.03 24.16 1.12 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.534 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 82.7 m -89.71 -32.88 16.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.685 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.79 40.77 89.66 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.251 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.6 tt0 -140.4 150.34 43.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.478 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.42 109.64 15.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.286 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.422 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.83 62.34 6.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.478 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.47 70.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.02 0.438 . . . . 0.0 110.617 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.7 mt -81.29 -20.07 41.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.954 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.42 40.26 3.25 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.08 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 29.7 m -157.75 129.28 6.8 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 122.219 0.208 . . . . 0.0 110.498 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.591 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 26.7 m -113.56 123.35 49.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -81.43 -23.0 37.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 ' OE2' ' A' ' 7' ' ' GLU . 59.9 t -58.78 127.29 82.58 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.734 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.31 128.3 29.44 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.369 2.712 . . . . 0.0 114.288 -178.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t0 64.99 6.77 3.6 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.581 -1.19 . . . . 0.0 113.307 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -88.71 126.24 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.612 -0.68 . . . . 0.0 111.262 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.67 140.23 29.96 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.684 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.7 t -74.77 114.2 12.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.051 0.453 . . . . 0.0 110.629 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -114.51 49.98 0.99 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.471 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 49.3 t90 -18.14 129.14 0.04 OUTLIER Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 113.139 -1.846 . . . . 0.0 114.486 -176.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 83.3 Cg_endo -80.63 -18.71 24.09 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 C-N-CA 122.893 -1.711 . . . . 0.0 115.016 0.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.3 mt -91.98 147.72 5.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -87.18 134.34 33.54 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -131.49 143.12 50.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.346 0.593 . . . . 0.0 111.307 -179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.358 -0.134 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.86 115.25 63.44 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 117.075 0.437 . . . . 0.0 110.918 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.537 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 79.4 Cg_endo -79.22 39.55 0.83 Allowed 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.735 2.29 . . . . 0.0 112.38 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.6 p -85.48 25.86 0.99 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.427 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.5 m -89.74 -32.94 16.76 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.925 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.84 41.55 82.29 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.18 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.597 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.7 tt0 -142.18 155.01 45.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.483 HG22 HG23 ' A' ' 10' ' ' THR . 25.0 m -126.89 110.11 12.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.33 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 13' ' ' THR . 9.5 p -88.93 62.89 6.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.301 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.483 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -58.01 -35.77 71.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.004 0.431 . . . . 0.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -81.18 -20.14 41.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.952 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.29 39.78 3.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.42 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.1 m -157.66 129.1 6.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 122.238 0.215 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 29.7 m -112.65 123.52 50.49 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -81.34 -23.55 37.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.52 HG23 ' OE2' ' A' ' 7' ' ' GLU . 62.5 t -58.23 126.74 79.06 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.686 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.73 129.41 34.88 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.344 2.696 . . . . 0.0 114.338 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.6 t0 65.3 5.09 2.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.559 -1.201 . . . . 0.0 113.429 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.3 m -88.3 126.78 35.35 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.55 -0.719 . . . . 0.0 111.29 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.7 140.07 30.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.704 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.7 115.66 14.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.035 0.445 . . . . 0.0 110.712 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 62.4 m -116.07 49.98 1.07 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 178.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.472 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.5 t90 -17.77 128.76 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 113.059 -1.882 . . . . 0.0 114.51 -176.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 85.1 Cg_endo -81.27 -18.85 23.95 Favored 'Cis proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.889 -1.713 . . . . 0.0 114.866 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.5 mt -90.75 147.87 4.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.0 m -88.02 134.45 33.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.8 mtt -130.88 142.8 50.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.311 0.577 . . . . 0.0 111.419 -179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-O 120.36 -0.133 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.73 115.11 63.06 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 117.107 0.454 . . . . 0.0 110.9 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.5 Cg_endo -79.22 40.12 0.9 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.716 2.277 . . . . 0.0 112.405 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.1 p -85.78 23.14 1.48 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.472 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.0 m -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.84 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.45 38.25 79.76 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.643 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -139.98 148.84 42.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -120.99 114.2 21.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.31 0.576 . . . . 0.0 110.002 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.2 p -89.6 60.17 5.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.285 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.2 p -57.64 -35.81 71.0 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.119 0.485 . . . . 0.0 110.379 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.0 mt -81.62 -21.08 38.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.918 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.35 41.58 2.54 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.199 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.5 m -157.96 133.77 9.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.242 0.217 . . . . 0.0 110.468 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.643 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.4 m -118.59 121.06 39.3 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -81.19 -25.64 36.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.346 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.575 HG23 ' OE1' ' A' ' 7' ' ' GLU . 95.4 t -60.3 124.29 77.24 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-O 121.067 0.46 . . . . 0.0 110.422 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -45.65 126.37 8.77 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.824 3.016 . . . . 0.0 114.691 -178.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.2 t0 63.64 8.89 3.94 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.511 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -88.33 126.49 35.22 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.374 -0.829 . . . . 0.0 111.175 179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.5 m -90.21 144.41 25.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.797 -179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.402 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.2 t -76.65 111.94 12.69 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.028 0.442 . . . . 0.0 110.977 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.562 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.9 m -112.96 50.65 0.87 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -20.69 130.44 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.304 0 CA-C-N 113.277 -1.783 . . . . 0.0 114.284 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -82.57 -6.95 48.12 Favored 'Cis proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.094 -1.628 . . . . 0.0 115.086 0.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.3 mt -103.4 148.55 8.27 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 CA-C-O 121.258 0.551 . . . . 0.0 112.381 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -86.55 133.61 33.71 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 121.86 -0.525 . . . . 0.0 109.889 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.562 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -134.03 142.92 47.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 111.249 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.752 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.395 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.155 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.72 115.94 65.12 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 117.074 0.437 . . . . 0.0 110.793 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.411 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.1 Cg_endo -78.69 40.34 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.688 2.259 . . . . 0.0 112.57 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.4 p -84.66 31.85 0.52 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.285 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.67 -35.39 9.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.922 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 38.54 84.82 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.234 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.645 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.0 tt0 -139.46 148.99 43.48 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 t -120.88 114.44 21.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.421 0.629 . . . . 0.0 109.871 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.7 p -89.58 60.47 5.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.268 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -57.46 -36.12 71.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.107 0.48 . . . . 0.0 110.452 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.24 -20.85 36.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.925 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.42 42.12 2.42 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.291 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.4 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 36.0 m -157.52 134.32 10.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.421 -0.215 . . . . 0.0 110.421 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.645 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.2 m -119.89 120.85 37.62 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.38 -25.4 36.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.302 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.591 HG23 ' OE1' ' A' ' 7' ' ' GLU . 98.3 t -60.15 125.1 80.38 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.072 0.463 . . . . 0.0 110.429 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.96 125.31 6.56 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 123.903 3.068 . . . . 0.0 114.779 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.1 t0 62.55 10.76 4.27 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.551 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.9 m -88.5 125.97 35.02 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.271 -0.893 . . . . 0.0 111.047 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 m -89.96 144.68 25.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.8 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -76.14 111.17 11.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.006 0.432 . . . . 0.0 110.901 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.5 m -111.96 50.29 0.86 Allowed 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -20.5 130.35 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.333 0 CA-C-N 113.259 -1.791 . . . . 0.0 114.274 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.52 -6.96 47.99 Favored 'Cis proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.129 0.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -103.1 148.7 7.88 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-O 121.26 0.552 . . . . 0.0 112.318 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.5 m -86.59 133.55 33.71 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.857 -0.527 . . . . 0.0 109.966 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -135.17 144.77 47.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.276 0.56 . . . . 0.0 111.19 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.735 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.144 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.434 0 CA-C-O 120.339 -0.145 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.58 112.86 59.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 117.128 0.464 . . . . 0.0 110.895 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.45 40.67 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.687 2.258 . . . . 0.0 112.609 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -96.91 34.41 1.72 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 28' ' ' LYS . 57.6 m -101.72 -38.26 7.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.91 37.28 56.89 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.55 ' OE1' ' HB3' ' A' ' 14' ' ' CYS . 55.0 tt0 -133.54 152.75 51.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.63 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.4 p -128.69 115.1 17.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.251 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.7 p -89.22 61.43 5.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.053 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.1 -36.85 71.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.938 0.399 . . . . 0.0 110.548 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.4 mt -83.78 -18.31 38.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.756 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.32 41.14 2.84 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.151 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.413 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 52.1 m -156.45 133.19 10.26 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.874 -0.191 . . . . 0.0 110.854 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.55 ' HB3' ' OE1' ' A' ' 7' ' ' GLU . 31.8 m -121.97 119.41 31.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.3 p90 -81.91 -20.24 39.16 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.487 -178.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.2 t -64.55 121.41 72.72 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.222 0.534 . . . . 0.0 110.818 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.74 133.43 44.75 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.434 2.756 . . . . 0.0 113.681 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.598 ' HB3' ' HD2' ' A' ' 28' ' ' LYS . 29.7 t70 71.52 -5.18 1.68 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.347 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 62.2 m -88.2 129.3 35.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.569 0.699 . . . . 0.0 110.915 179.126 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m -100.27 148.78 24.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.818 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.4 t -75.03 116.57 15.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.931 0.396 . . . . 0.0 110.823 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 50.5 m -121.0 49.48 1.48 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.8 t90 -19.29 129.92 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.4 0 O-C-N 125.569 1.793 . . . . 0.0 114.459 -177.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -81.84 -13.68 36.73 Favored 'Cis proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.174 -1.594 . . . . 0.0 114.827 0.023 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.3 mt -94.63 150.02 4.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 121.214 0.531 . . . . 0.0 112.25 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.8 m -92.78 128.5 38.66 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 121.798 -0.564 . . . . 0.0 110.337 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.528 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 53.4 mtt -118.49 135.07 54.59 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HD2' ' HB3' ' A' ' 18' ' ' ASP . 10.4 ttpp . . . . . 0 C--N 1.307 -1.25 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.432 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 120.406 -0.108 . . . . 0.0 113.102 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.54 64.1 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.949 0.375 . . . . 0.0 110.885 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 83.1 Cg_endo -79.02 40.39 0.93 Allowed 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.748 2.299 . . . . 0.0 112.418 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -85.57 23.26 1.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.489 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.8 m -89.75 -33.76 16.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.08 39.29 73.39 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.403 ' OE1' HG23 ' A' ' 16' ' ' VAL . 59.6 tt0 -140.87 149.5 42.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.078 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -122.56 112.68 18.3 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.815 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.451 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.6 p -88.61 60.93 5.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.314 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.6 p -58.09 -35.08 70.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.997 0.427 . . . . 0.0 110.337 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.4 mt -82.08 -21.14 36.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.938 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.04 40.84 2.75 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.191 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.3 m -157.68 133.06 8.95 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.214 0.205 . . . . 0.0 110.477 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.3 m -118.17 119.98 36.35 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -81.38 -21.01 39.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.218 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.403 HG23 ' OE1' ' A' ' 7' ' ' GLU . 61.7 t -62.38 128.39 91.23 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -51.27 125.37 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 123.437 2.758 . . . . 0.0 114.25 -177.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.8 t0 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.484 -1.235 . . . . 0.0 113.082 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -89.2 126.63 35.57 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 111.114 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.9 m -90.41 143.43 26.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.908 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.0 t -75.98 109.66 9.79 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.048 0.451 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.567 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.7 m -111.38 50.47 0.83 Allowed 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -20.79 130.48 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.321 -176.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.57 -2.76 55.04 Favored 'Cis proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.242 -1.566 . . . . 0.0 115.066 0.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.7 mt -106.73 148.44 11.09 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 CA-C-O 121.215 0.531 . . . . 0.0 112.147 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.62 133.43 33.81 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 121.818 -0.551 . . . . 0.0 110.082 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.567 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.2 mtt -133.2 145.17 50.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 111.291 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.484 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -108.16 104.22 13.59 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.401 ' CG ' ' HE2' ' A' ' 28' ' ' LYS . 71.3 m-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.314 -178.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.043 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.43 115.94 65.04 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 117.102 0.451 . . . . 0.0 110.92 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.6 Cg_endo -79.26 40.17 0.91 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.72 2.28 . . . . 0.0 112.451 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -84.59 22.36 1.32 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.575 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 65.1 m -89.66 -34.57 16.22 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.713 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 39.08 85.37 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.422 ' OE1' HG23 ' A' ' 16' ' ' VAL . 68.3 tt0 -135.89 150.82 49.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.264 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.9 108.17 13.13 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.814 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 13.6 p -89.04 61.52 5.89 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.346 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.468 HG23 HG22 ' A' ' 8' ' ' THR . 1.2 p -57.69 -35.56 70.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.044 0.449 . . . . 0.0 110.544 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -81.68 -20.23 39.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.037 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.83 41.26 2.92 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.114 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.6 m -156.11 132.55 10.16 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.9 m -118.3 120.11 36.64 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -81.18 -20.75 40.53 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.126 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.422 HG23 ' OE1' ' A' ' 7' ' ' GLU . 57.5 t -62.18 128.49 91.06 Favored Pre-proline 0 C--O 1.234 0.259 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -50.28 124.2 12.55 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 123.527 2.818 . . . . 0.0 114.342 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 63.04 13.33 6.66 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.448 -1.251 . . . . 0.0 113.084 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.0 m -89.5 126.98 35.8 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.262 -0.899 . . . . 0.0 111.254 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -90.04 143.73 26.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.607 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.7 t -78.09 105.5 9.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.915 0.388 . . . . 0.0 111.004 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.566 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.7 m -104.85 50.77 0.78 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.0 t90 -19.74 129.31 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 O-C-N 125.511 1.757 . . . . 0.0 114.351 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.37 -15.99 30.9 Favored 'Cis proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.905 -1.706 . . . . 0.0 115.06 0.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.5 mt -92.95 146.99 5.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 CA-C-O 121.535 0.683 . . . . 0.0 112.764 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.1 m -86.54 134.14 33.68 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.566 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.7 mtt -133.35 143.83 49.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 111.415 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -106.98 104.67 14.4 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 177.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.409 ' CG ' ' HE2' ' A' ' 28' ' ' LYS . 72.4 m-20 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.349 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 120.372 -0.127 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.62 114.7 61.59 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 117.14 0.47 . . . . 0.0 110.923 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 87.1 Cg_endo -79.61 40.27 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.716 2.278 . . . . 0.0 112.48 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.8 p -84.73 20.63 1.73 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.492 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.4 m -89.61 -35.8 15.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.808 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.52 37.89 90.15 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.512 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.64 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 20.2 tt0 -133.95 148.62 51.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' THR . 13.5 m -116.75 108.66 16.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.105 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 13' ' ' THR . 11.3 p -89.06 61.63 5.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.488 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.55 -36.14 71.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 0.0 110.598 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.67 -17.7 40.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.14 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.04 42.85 2.95 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.038 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.412 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 39.4 m -155.46 134.75 12.35 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.64 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 47.2 m -121.66 121.28 37.0 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -81.22 -24.42 37.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.233 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.572 HG23 ' OE1' ' A' ' 7' ' ' GLU . 97.1 t -60.55 125.87 83.46 Favored Pre-proline 0 C--O 1.233 0.225 0 CA-C-O 121.02 0.438 . . . . 0.0 110.373 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -43.69 123.61 3.93 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 123.958 3.106 . . . . 0.0 114.93 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.3 t0 60.94 13.58 4.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.463 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 m -88.71 125.44 34.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 121.327 -0.858 . . . . 0.0 111.308 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 m -89.97 142.26 27.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.521 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -74.8 115.23 14.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.408 . . . . 0.0 110.834 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.0 m -115.21 49.14 1.09 Allowed 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -17.64 129.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.318 0 CA-C-N 113.021 -1.899 . . . . 0.0 114.605 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.55 -18.54 24.47 Favored 'Cis proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.885 -1.714 . . . . 0.0 114.934 -0.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.7 mt -91.95 147.96 4.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.29 134.96 33.71 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.2 mtt -134.6 141.27 46.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.307 0.575 . . . . 0.0 111.217 -179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -102.78 103.48 13.7 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.45 -178.659 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.69 115.31 63.53 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 117.171 0.486 . . . . 0.0 110.782 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.428 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.4 Cg_endo -78.75 40.32 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.775 2.317 . . . . 0.0 112.687 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.1 p -84.7 27.92 0.7 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.382 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.6 m -96.68 -35.2 11.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.24 38.03 87.24 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.631 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -138.68 146.43 41.59 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.8 p -116.97 112.3 20.8 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.087 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.3 p -88.83 61.12 5.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.277 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.1 p -58.29 -35.09 71.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.068 0.461 . . . . 0.0 110.386 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.95 -21.02 34.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.005 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.95 42.51 2.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.253 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.407 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 37.2 m -157.6 135.15 10.51 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.631 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 55.6 m -121.13 120.97 36.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.5 -25.61 35.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.428 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.597 HG23 ' OE1' ' A' ' 7' ' ' GLU . 85.6 t -60.45 127.39 86.54 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.049 0.452 . . . . 0.0 110.44 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -43.43 123.4 3.57 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 124.021 3.147 . . . . 0.0 114.955 -178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.71 16.86 5.82 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.517 -1.219 . . . . 0.0 113.286 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.0 m -89.27 125.24 35.01 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.19 -0.944 . . . . 0.0 111.036 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -89.87 142.64 27.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.519 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -75.2 110.84 9.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.067 0.46 . . . . 0.0 111.07 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.564 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.7 m -111.97 49.79 0.89 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.9 t90 -19.87 130.57 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 CA-C-N 113.172 -1.831 . . . . 0.0 114.356 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.36 -2.9 54.31 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.227 -1.572 . . . . 0.0 115.139 0.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -107.25 148.35 11.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 CA-C-O 121.253 0.549 . . . . 0.0 112.08 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.41 134.27 33.72 Favored 'General case' 0 C--N 1.317 -0.837 0 O-C-N 121.798 -0.564 . . . . 0.0 110.254 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -134.92 143.72 47.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.214 0.531 . . . . 0.0 111.047 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -105.88 103.23 12.68 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.135 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.415 -178.58 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.5 63.99 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 117.033 0.416 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -78.93 39.97 0.87 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.3 p -84.49 23.82 1.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.519 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 85.2 m -89.65 -33.59 16.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.601 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.23 37.57 86.77 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.521 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.637 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -135.1 147.53 49.56 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' THR . 14.8 m -117.4 108.37 15.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.005 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.3 p -88.89 61.5 5.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.382 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.496 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.89 -35.5 71.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.052 0.453 . . . . 0.0 110.455 178.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.68 -19.81 40.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.02 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.36 41.24 3.03 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.181 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.9 m -156.7 132.95 9.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.637 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 45.7 m -117.44 122.24 43.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -81.1 -24.68 37.54 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.123 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.581 HG23 ' OE1' ' A' ' 7' ' ' GLU . 92.0 t -60.25 127.61 86.46 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.55 127.92 26.09 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.352 2.701 . . . . 0.0 114.225 -177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.8 t0 65.23 9.08 5.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.148 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.8 m -89.11 125.49 35.05 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.444 -0.785 . . . . 0.0 111.261 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.8 m -90.25 141.19 28.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.722 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -75.94 112.57 12.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.002 0.429 . . . . 0.0 110.704 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.6 m -112.86 50.19 0.89 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 48.8 t90 -17.98 129.14 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.786 1.929 . . . . 0.0 114.539 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.475 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 90.0 Cg_endo -81.29 -16.88 28.81 Favored 'Cis proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.97 -1.679 . . . . 0.0 114.921 -0.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -93.13 147.88 5.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -86.87 134.92 33.49 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.0 mtt -131.13 144.47 51.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.291 0.567 . . . . 0.0 111.281 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -109.98 103.95 12.78 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.373 -178.355 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 CA-C-O 120.399 -0.112 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.71 115.63 64.33 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 117.048 0.424 . . . . 0.0 110.885 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -79.27 41.25 1.06 Allowed 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.789 2.326 . . . . 0.0 112.401 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.9 p -84.08 22.04 1.26 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.476 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 66.7 m -89.75 -34.72 16.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.741 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.47 37.26 89.86 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.507 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.641 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.5 tt0 -134.2 147.79 50.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.489 HG22 HG23 ' A' ' 10' ' ' THR . 13.8 m -116.98 108.36 15.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.026 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.9 p -88.94 61.25 5.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.381 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.489 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.98 -35.4 71.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.063 0.458 . . . . 0.0 110.449 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.9 mt -81.86 -20.15 39.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.998 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.69 41.77 2.84 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.197 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.424 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 27.9 m -156.76 133.52 10.2 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.641 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.4 m -118.74 122.14 41.75 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -81.06 -24.86 37.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.607 HG23 ' OE1' ' A' ' 7' ' ' GLU . 99.2 t -59.74 128.17 86.17 Favored Pre-proline 0 C--O 1.233 0.221 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -51.68 126.89 20.99 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.542 2.828 . . . . 0.0 114.254 -177.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.0 t0 64.17 11.13 6.03 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 114.499 -1.228 . . . . 0.0 113.059 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 m -89.18 124.9 34.78 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.344 -0.848 . . . . 0.0 111.259 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -89.98 141.23 28.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.621 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.6 t -75.56 112.18 11.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.572 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 54.2 m -111.87 49.78 0.88 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -18.06 129.3 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 113.048 -1.887 . . . . 0.0 114.499 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.02 -17.22 27.96 Favored 'Cis proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.986 -1.673 . . . . 0.0 114.871 -0.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.4 mt -92.81 147.8 5.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.5 m -86.43 134.78 33.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.1 mtt -132.82 144.26 50.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.368 0.604 . . . . 0.0 111.249 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -108.53 103.51 12.65 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.374 -178.467 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.338 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -93.48 118.25 67.53 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 117.222 0.511 . . . . 0.0 110.675 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -74.68 38.84 0.53 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.744 2.296 . . . . 0.0 112.924 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -81.73 52.42 1.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.007 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.5 m -140.06 -43.32 0.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.235 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.32 35.21 76.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.379 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.615 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 19.3 tt0 -121.92 149.3 43.62 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 HG23 ' A' ' 10' ' ' THR . 11.0 m -115.51 107.37 15.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.934 0.397 . . . . 0.0 110.366 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.404 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.3 p -89.17 61.39 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.207 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.518 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.39 -35.94 70.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.012 0.434 . . . . 0.0 110.577 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.13 -17.79 41.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.83 41.96 3.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.883 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.404 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.0 m -156.13 134.23 11.33 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.313 0.245 . . . . 0.0 110.353 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 36.4 m -118.9 121.02 39.01 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -81.06 -25.26 37.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.063 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.47 HG23 ' OE1' ' A' ' 7' ' ' GLU . 87.5 t -62.76 125.94 87.48 Favored Pre-proline 0 C--O 1.235 0.309 0 CA-C-O 121.028 0.442 . . . . 0.0 109.952 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.23 138.09 64.7 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.711 2.274 . . . . 0.0 112.831 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 33.2 t0 65.65 45.76 2.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.431 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.41 127.25 17.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.688 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -99.79 145.25 27.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.329 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -71.98 117.64 13.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.001 0.429 . . . . 0.0 110.671 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.537 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.2 m -117.93 47.1 1.63 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -16.47 129.06 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.773 1.921 . . . . 0.0 114.718 -176.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -79.55 -21.04 18.33 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.89 -1.713 . . . . 0.0 114.962 -0.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -90.38 148.35 4.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.605 0 CA-C-O 121.452 0.644 . . . . 0.0 112.579 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.4 m -86.24 131.08 34.31 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 121.944 -0.472 . . . . 0.0 109.729 178.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.537 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.4 mtm -134.43 142.53 47.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.353 0.597 . . . . 0.0 111.196 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -95.78 101.87 13.6 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.871 178.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.091 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 CA-C-O 120.351 -0.138 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.56 114.46 60.63 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 117.124 0.462 . . . . 0.0 110.724 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.3 Cg_endo -76.29 37.89 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.662 2.241 . . . . 0.0 112.756 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -86.7 40.1 0.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.124 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.7 m -108.87 -34.55 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.665 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.7 41.4 56.7 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.627 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.8 tt0 -143.99 147.28 33.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.8 p -119.37 111.78 18.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.85 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 14.3 p -88.55 61.72 6.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.439 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.37 -34.0 70.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 110.43 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.4 mt -80.45 -22.22 41.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.948 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.13 39.07 3.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.273 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 23.0 m -158.9 130.91 6.6 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 122.296 0.238 . . . . 0.0 110.391 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.627 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 58.2 m -111.85 121.78 45.99 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -81.25 -25.75 36.36 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.501 HG23 ' OE1' ' A' ' 7' ' ' GLU . 74.5 t -62.19 124.35 81.9 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 121.073 0.463 . . . . 0.0 109.911 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.85 138.69 64.52 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.642 2.228 . . . . 0.0 112.618 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.5 t0 66.85 45.55 1.84 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.403 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.8 m -145.02 130.38 18.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m -97.61 148.63 23.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.523 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -79.75 103.79 9.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.936 0.398 . . . . 0.0 111.056 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.561 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.0 m -104.23 52.17 0.76 Allowed 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 178.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 58.5 t90 -22.01 130.3 0.07 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 125.278 1.611 . . . . 0.0 114.142 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -84.75 1.57 62.25 Favored 'Cis proline' 0 C--N 1.346 0.405 0 C-N-CA 123.235 -1.569 . . . . 0.0 115.134 0.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.6 mt -110.5 146.84 15.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 112.182 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.7 m -85.43 132.44 34.22 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 121.805 -0.559 . . . . 0.0 110.161 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.1 mtt -133.43 144.54 49.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.173 0.511 . . . . 0.0 111.057 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -102.45 105.43 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.797 -178.807 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -92.73 116.44 66.5 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 117.196 0.498 . . . . 0.0 110.936 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -78.86 40.25 0.91 Allowed 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.776 2.318 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.6 p -85.79 21.93 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.467 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.4 m -89.65 -34.49 16.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.63 37.51 89.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.193 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -138.24 146.68 42.87 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -117.12 112.53 21.0 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.9 p -88.81 60.65 5.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.9 p -58.15 -35.02 70.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.004 0.43 . . . . 0.0 110.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -20.56 34.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.976 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.55 42.16 2.58 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.213 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.4 m -157.93 134.91 9.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.9 m -120.33 120.92 37.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -81.25 -25.67 36.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.492 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.587 HG23 ' OE1' ' A' ' 7' ' ' GLU . 89.2 t -60.37 126.97 85.76 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 121.022 0.439 . . . . 0.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -43.55 123.93 3.96 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.957 3.104 . . . . 0.0 114.869 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 60.27 15.87 5.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.399 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.3 m -89.24 124.81 34.72 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 121.185 -0.947 . . . . 0.0 110.973 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m -89.79 141.48 28.58 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.617 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -73.97 114.47 12.33 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.16 0.505 . . . . 0.0 110.942 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.7 m -115.52 48.54 1.18 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.47 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 51.3 t90 -18.94 130.01 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 125.553 1.783 . . . . 0.0 114.443 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 97.2 Cg_endo -82.97 -5.03 51.29 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.168 -1.597 . . . . 0.0 115.15 0.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mt -105.39 149.0 9.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 CA-C-O 121.144 0.497 . . . . 0.0 112.097 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 68.3 m -88.07 133.39 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.737 -0.602 . . . . 0.0 110.347 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -132.97 142.15 48.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.282 0.563 . . . . 0.0 111.205 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -105.04 106.67 17.27 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.179 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 . . . . . 0 N--CA 1.465 0.31 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.458 -178.779 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 120.501 -0.055 . . . . 0.0 113.083 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.56 115.84 65.28 Favored Pre-proline 0 C--N 1.328 -0.341 0 O-C-N 122.492 -0.417 . . . . 0.0 110.699 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 27' ' ' MET . 74.5 Cg_endo -75.86 36.97 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.624 2.216 . . . . 0.0 112.555 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -86.18 42.05 0.97 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.7 m -111.45 -35.49 5.8 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.482 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.0 42.21 69.17 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.429 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -138.55 151.49 47.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.841 0.353 . . . . 0.0 110.465 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.479 HG22 HG23 ' A' ' 10' ' ' THR . 18.7 m -122.42 109.08 13.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.729 -0.668 . . . . 0.0 109.57 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.5 p -88.81 61.57 6.03 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.423 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.479 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.86 71.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.096 0.474 . . . . 0.0 110.452 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.3 mt -81.84 -20.94 37.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.986 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.79 41.38 2.69 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.001 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 54.2 m -156.46 134.32 11.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 45.3 m -120.22 119.08 32.19 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -81.61 -20.53 39.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.955 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.38 129.61 92.58 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.829 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -47.71 134.0 22.0 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 123.71 2.94 . . . . 0.0 113.967 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.586 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 44.79 34.08 1.11 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.334 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.7 m -108.45 128.33 54.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.172 0.511 . . . . 0.0 110.561 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -92.46 143.92 25.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.871 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.0 t -75.19 110.72 9.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.947 0.403 . . . . 0.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 52.0 m -111.52 49.78 0.87 Allowed 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.68 128.65 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.256 0 O-C-N 125.651 1.844 . . . . 0.0 114.451 -176.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -81.22 -19.4 22.58 Favored 'Cis proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.783 -1.757 . . . . 0.0 114.836 -0.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.2 mt -88.67 148.03 4.82 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-O 121.441 0.639 . . . . 0.0 112.713 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.2 m -89.42 132.84 34.8 Favored 'General case' 0 C--N 1.318 -0.764 0 O-C-N 122.017 -0.427 . . . . 0.0 109.945 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.7 mtt -128.14 141.84 51.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 110.754 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 8.3 ttpt -104.24 104.63 14.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.421 -178.53 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 CA-C-O 120.418 -0.101 . . . . 0.0 113.17 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.74 115.6 64.27 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 117.133 0.466 . . . . 0.0 110.859 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.6 Cg_endo -78.89 40.57 0.95 Allowed 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.699 2.266 . . . . 0.0 112.591 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.3 p -85.07 29.92 0.62 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.358 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.4 m -99.36 -35.36 9.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.969 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.85 38.72 75.99 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -138.79 151.92 47.46 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.079 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 t -125.08 114.51 19.16 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.44 0.638 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.4 p -89.5 60.73 5.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.263 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.19 -36.43 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.078 0.466 . . . . 0.0 110.497 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.73 -19.8 37.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.96 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.46 41.98 2.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.235 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.5 m -156.97 134.13 10.43 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.5 m -120.46 119.15 32.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -81.46 -20.72 39.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.327 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.7 t -63.23 126.25 88.8 Favored Pre-proline 0 C--O 1.233 0.233 0 CA-C-O 121.0 0.429 . . . . 0.0 110.349 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -43.99 122.53 3.56 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.946 3.098 . . . . 0.0 114.842 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.2 t0 61.48 13.19 4.9 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.4 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 21.2 m -88.74 127.39 35.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.356 -0.84 . . . . 0.0 111.089 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -91.02 144.08 26.03 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.872 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.403 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.1 t -75.06 111.14 9.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.045 0.45 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 57.5 m -112.54 50.07 0.89 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.7 t90 -20.57 130.1 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 113.321 -1.763 . . . . 0.0 114.297 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.46 -8.6 45.95 Favored 'Cis proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.042 0.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.1 mt -100.76 148.74 6.67 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.72 133.17 33.9 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 121.822 -0.548 . . . . 0.0 109.764 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 48.1 mtt -134.89 145.66 48.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.255 0.55 . . . . 0.0 111.314 -178.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.36 103.88 13.44 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.032 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.438 -178.674 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 120.325 -0.153 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -97.53 119.56 62.5 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 117.157 0.479 . . . . 0.0 110.567 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.24 36.07 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.703 2.269 . . . . 0.0 112.738 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -84.77 49.34 1.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.831 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 58.6 m -125.29 -37.72 2.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.552 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.34 42.18 75.46 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.519 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -135.81 152.16 50.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.889 0.376 . . . . 0.0 110.27 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.48 HG22 HG23 ' A' ' 10' ' ' THR . 18.3 m -122.66 109.98 14.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.744 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.1 p -88.97 61.61 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.331 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.48 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.55 -36.49 71.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.7 mt -82.72 -19.26 38.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.095 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 42.0 2.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.02 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.0 m -156.17 135.18 11.98 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 38.4 m -121.95 118.69 29.46 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -81.67 -20.46 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.178 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 99.1 t -64.02 128.34 92.89 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.504 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_exo -40.68 129.79 2.67 Favored 'Trans proline' 0 C--O 1.237 0.449 0 C-N-CA 124.077 3.185 . . . . 0.0 114.719 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.538 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 43.76 30.78 0.4 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.76 179.257 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 m -101.29 125.65 47.94 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.197 0.523 . . . . 0.0 110.408 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 m -90.04 143.49 26.73 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.851 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.2 t -72.99 114.91 11.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.959 0.409 . . . . 0.0 110.664 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.534 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 67.6 m -115.31 48.0 1.24 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.3 t90 -17.99 128.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 125.647 1.842 . . . . 0.0 114.434 -176.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -80.34 -22.57 15.68 Favored 'Cis proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.737 -1.776 . . . . 0.0 114.82 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.9 148.83 4.47 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 CA-C-O 121.454 0.645 . . . . 0.0 112.666 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.4 m -90.41 131.73 36.01 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.886 -0.509 . . . . 0.0 110.004 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 43.6 mtm -129.6 140.1 51.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.431 0.634 . . . . 0.0 110.692 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 11.6 ttpt -101.16 107.96 19.51 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.939 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.686 -178.897 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-O 120.277 -0.18 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 113.74 58.14 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 117.273 0.536 . . . . 0.0 110.929 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.438 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.1 Cg_endo -76.48 38.59 0.62 Allowed 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.708 2.272 . . . . 0.0 112.837 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -89.85 35.8 0.85 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.29 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.0 m -102.73 -34.55 8.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.72 40.49 65.37 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.703 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.613 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.9 tt0 -142.04 147.42 36.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.9 p -118.71 112.75 20.17 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.136 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.416 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.6 p -88.7 62.34 6.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.246 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -58.27 -35.01 71.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.069 0.461 . . . . 0.0 110.493 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.6 mt -83.12 -17.66 42.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.025 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.44 40.64 3.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.068 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 22.9 m -157.77 132.3 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.352 0.261 . . . . 0.0 110.353 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.613 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 56.0 m -115.47 120.25 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.9 p90 -81.14 -26.14 36.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.076 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 71.5 t -62.27 118.92 44.72 Favored Pre-proline 0 C--O 1.235 0.296 0 CA-C-O 121.146 0.498 . . . . 0.0 110.513 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -56.0 137.87 80.52 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.116 2.544 . . . . 0.0 112.805 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 42.1 t0 66.12 45.12 2.43 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.498 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 38.9 m -143.92 130.55 20.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.224 0.535 . . . . 0.0 110.81 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.0 m -99.85 146.95 26.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.637 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.55 115.34 16.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.033 0.444 . . . . 0.0 110.959 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -117.47 50.39 1.12 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -19.94 130.72 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.417 0 CA-C-N 113.21 -1.814 . . . . 0.0 114.4 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.03 -4.31 52.11 Favored 'Cis proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.266 -1.556 . . . . 0.0 115.074 0.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 32.2 mt -106.26 148.7 10.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 CA-C-O 121.265 0.555 . . . . 0.0 112.156 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.24 134.61 33.52 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.865 -0.522 . . . . 0.0 110.254 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.9 mtt -132.07 143.04 49.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.24 0.543 . . . . 0.0 111.019 -179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 ttpt -99.1 103.98 15.94 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.85 -179.118 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -94.07 117.19 67.14 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 117.2 0.5 . . . . 0.0 110.916 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.59 40.48 0.92 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.883 2.389 . . . . 0.0 112.413 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.9 p -86.61 22.7 1.83 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.498 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.1 m -89.62 -34.12 16.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.833 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.4 38.82 70.28 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -139.93 152.53 46.45 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.078 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.3 t -126.29 114.84 18.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.453 0.644 . . . . 0.0 109.759 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.45 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 10.3 p -89.49 60.75 5.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.212 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.0 p -57.24 -36.31 70.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.152 0.501 . . . . 0.0 110.428 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.93 -19.13 41.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.982 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.66 40.5 3.14 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.038 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.2 m -157.51 132.7 8.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 122.17 0.188 . . . . 0.0 110.524 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 53.6 m -117.12 120.26 37.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -81.41 -20.64 39.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.167 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.69 126.67 88.97 Favored Pre-proline 0 C--O 1.233 0.2 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -53.16 127.61 25.78 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.322 2.682 . . . . 0.0 114.013 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.9 t0 66.97 5.48 4.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.604 -1.18 . . . . 0.0 113.134 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.9 m -88.39 129.01 35.52 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 121.488 -0.757 . . . . 0.0 111.186 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.31 143.45 26.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.056 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.445 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t -74.51 115.4 14.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.065 0.46 . . . . 0.0 110.798 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.583 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 60.8 m -117.28 49.51 1.19 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -20.04 129.72 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 125.46 1.725 . . . . 0.0 114.255 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.78 -11.97 40.09 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.105 -1.623 . . . . 0.0 115.174 0.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 31.1 mt -98.24 149.82 5.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.62 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.42 132.27 35.08 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.712 -0.617 . . . . 0.0 109.775 178.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.583 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -131.44 144.21 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.455 0.645 . . . . 0.0 111.539 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -106.76 107.53 18.59 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.131 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.407 ' CG ' ' HE2' ' A' ' 28' ' ' LYS . 74.2 m-20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.617 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-O 120.276 -0.18 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -95.16 116.63 66.52 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 117.237 0.518 . . . . 0.0 110.813 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.43 38.19 0.54 Allowed 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.736 2.291 . . . . 0.0 112.871 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -88.69 40.47 0.97 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.232 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 76.1 m -110.95 -34.57 6.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.694 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.33 42.07 66.48 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.995 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.3 tt0 -143.02 147.42 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.6 p -118.76 112.46 19.77 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.067 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.408 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.68 62.06 6.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.162 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.19 -34.7 70.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.088 0.471 . . . . 0.0 110.509 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.1 mt -82.73 -19.2 38.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.91 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.88 40.26 3.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.093 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.4 m -158.29 132.01 7.75 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 122.346 0.258 . . . . 0.0 110.363 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.622 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.7 m -113.89 121.45 44.0 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -81.1 -25.26 37.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.983 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 75.7 t -62.5 124.69 83.8 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.065 0.459 . . . . 0.0 109.834 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.53 138.17 63.59 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.644 2.23 . . . . 0.0 112.746 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 20.1 t0 66.59 44.52 2.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.592 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 m -143.03 130.55 21.19 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.612 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -99.29 145.8 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.864 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.93 116.22 15.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.047 0.451 . . . . 0.0 110.678 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 65.4 m -117.92 49.45 1.24 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -19.25 130.08 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 114.428 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.96 -5.16 51.12 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.195 -1.585 . . . . 0.0 115.123 0.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.2 mt -105.53 148.97 9.32 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 CA-C-O 121.179 0.514 . . . . 0.0 112.113 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.1 m -87.85 132.18 34.28 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 121.773 -0.579 . . . . 0.0 110.271 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.1 mtm -129.87 141.82 50.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.492 0.663 . . . . 0.0 110.999 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 4.3 ttpt -99.02 106.76 19.04 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.845 178.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.005 -179.185 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.75 115.13 63.1 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 117.165 0.483 . . . . 0.0 111.002 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.518 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.9 Cg_endo -79.19 39.63 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.768 2.312 . . . . 0.0 112.302 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -85.03 24.16 1.12 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.534 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 82.7 m -89.71 -32.88 16.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.685 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.79 40.77 89.66 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.251 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.6 tt0 -140.4 150.34 43.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.478 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.42 109.64 15.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.286 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.422 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.83 62.34 6.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.478 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.47 70.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.02 0.438 . . . . 0.0 110.617 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.7 mt -81.29 -20.07 41.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.954 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.42 40.26 3.25 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.08 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 29.7 m -157.75 129.28 6.8 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 122.219 0.208 . . . . 0.0 110.498 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.591 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 26.7 m -113.56 123.35 49.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -81.43 -23.0 37.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 ' OE2' ' A' ' 7' ' ' GLU . 59.9 t -58.78 127.29 82.58 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.734 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.31 128.3 29.44 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.369 2.712 . . . . 0.0 114.288 -178.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t0 64.99 6.77 3.6 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.581 -1.19 . . . . 0.0 113.307 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -88.71 126.24 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.612 -0.68 . . . . 0.0 111.262 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.67 140.23 29.96 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.684 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.7 t -74.77 114.2 12.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.051 0.453 . . . . 0.0 110.629 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -114.51 49.98 0.99 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.471 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 49.3 t90 -18.14 129.14 0.04 OUTLIER Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 113.139 -1.846 . . . . 0.0 114.486 -176.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 83.3 Cg_endo -80.63 -18.71 24.09 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 C-N-CA 122.893 -1.711 . . . . 0.0 115.016 0.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.3 mt -91.98 147.72 5.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -87.18 134.34 33.54 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -131.49 143.12 50.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.346 0.593 . . . . 0.0 111.307 -179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.48 103.81 13.36 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.887 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.313 -178.507 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.358 -0.134 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.86 115.25 63.44 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 117.075 0.437 . . . . 0.0 110.918 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.537 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 79.4 Cg_endo -79.22 39.55 0.83 Allowed 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.735 2.29 . . . . 0.0 112.38 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.6 p -85.48 25.86 0.99 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.427 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.5 m -89.74 -32.94 16.76 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.925 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.84 41.55 82.29 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.18 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.597 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.7 tt0 -142.18 155.01 45.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.483 HG22 HG23 ' A' ' 10' ' ' THR . 25.0 m -126.89 110.11 12.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.33 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 13' ' ' THR . 9.5 p -88.93 62.89 6.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.301 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.483 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -58.01 -35.77 71.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.004 0.431 . . . . 0.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -81.18 -20.14 41.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.952 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.29 39.78 3.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.42 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.1 m -157.66 129.1 6.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 122.238 0.215 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 29.7 m -112.65 123.52 50.49 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -81.34 -23.55 37.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.52 HG23 ' OE2' ' A' ' 7' ' ' GLU . 62.5 t -58.23 126.74 79.06 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.686 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.73 129.41 34.88 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.344 2.696 . . . . 0.0 114.338 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.6 t0 65.3 5.09 2.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.559 -1.201 . . . . 0.0 113.429 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.3 m -88.3 126.78 35.35 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.55 -0.719 . . . . 0.0 111.29 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.7 140.07 30.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.704 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.7 115.66 14.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.035 0.445 . . . . 0.0 110.712 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 62.4 m -116.07 49.98 1.07 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 178.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.472 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.5 t90 -17.77 128.76 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 113.059 -1.882 . . . . 0.0 114.51 -176.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 85.1 Cg_endo -81.27 -18.85 23.95 Favored 'Cis proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.889 -1.713 . . . . 0.0 114.866 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.5 mt -90.75 147.87 4.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.0 m -88.02 134.45 33.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.8 mtt -130.88 142.8 50.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.311 0.577 . . . . 0.0 111.419 -179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -107.1 103.41 12.81 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 177.995 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.315 -178.435 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-O 120.36 -0.133 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.73 115.11 63.06 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 117.107 0.454 . . . . 0.0 110.9 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.5 Cg_endo -79.22 40.12 0.9 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.716 2.277 . . . . 0.0 112.405 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.1 p -85.78 23.14 1.48 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.472 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.0 m -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.84 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.45 38.25 79.76 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.643 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -139.98 148.84 42.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -120.99 114.2 21.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.31 0.576 . . . . 0.0 110.002 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.2 p -89.6 60.17 5.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.285 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.2 p -57.64 -35.81 71.0 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.119 0.485 . . . . 0.0 110.379 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.0 mt -81.62 -21.08 38.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.918 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.35 41.58 2.54 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.199 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.5 m -157.96 133.77 9.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.242 0.217 . . . . 0.0 110.468 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.643 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.4 m -118.59 121.06 39.3 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -81.19 -25.64 36.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.346 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.575 HG23 ' OE1' ' A' ' 7' ' ' GLU . 95.4 t -60.3 124.29 77.24 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-O 121.067 0.46 . . . . 0.0 110.422 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -45.65 126.37 8.77 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.824 3.016 . . . . 0.0 114.691 -178.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.2 t0 63.64 8.89 3.94 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.511 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -88.33 126.49 35.22 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.374 -0.829 . . . . 0.0 111.175 179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.5 m -90.21 144.41 25.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.797 -179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.402 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.2 t -76.65 111.94 12.69 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.028 0.442 . . . . 0.0 110.977 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.562 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.9 m -112.96 50.65 0.87 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -20.69 130.44 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.304 0 CA-C-N 113.277 -1.783 . . . . 0.0 114.284 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -82.57 -6.95 48.12 Favored 'Cis proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.094 -1.628 . . . . 0.0 115.086 0.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.3 mt -103.4 148.55 8.27 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 CA-C-O 121.258 0.551 . . . . 0.0 112.381 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -86.55 133.61 33.71 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 121.86 -0.525 . . . . 0.0 109.889 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.562 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -134.03 142.92 47.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 111.249 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -105.37 104.24 13.92 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.952 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.406 -178.486 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.395 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.155 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.72 115.94 65.12 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 117.074 0.437 . . . . 0.0 110.793 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.411 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.1 Cg_endo -78.69 40.34 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.688 2.259 . . . . 0.0 112.57 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.4 p -84.66 31.85 0.52 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.285 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.67 -35.39 9.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.922 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 38.54 84.82 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.234 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.645 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.0 tt0 -139.46 148.99 43.48 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 t -120.88 114.44 21.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.421 0.629 . . . . 0.0 109.871 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.7 p -89.58 60.47 5.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.268 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -57.46 -36.12 71.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.107 0.48 . . . . 0.0 110.452 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.24 -20.85 36.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.925 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.42 42.12 2.42 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.291 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.4 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 36.0 m -157.52 134.32 10.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.421 -0.215 . . . . 0.0 110.421 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.645 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.2 m -119.89 120.85 37.62 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.38 -25.4 36.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.302 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.591 HG23 ' OE1' ' A' ' 7' ' ' GLU . 98.3 t -60.15 125.1 80.38 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.072 0.463 . . . . 0.0 110.429 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.96 125.31 6.56 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 123.903 3.068 . . . . 0.0 114.779 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.1 t0 62.55 10.76 4.27 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.551 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.9 m -88.5 125.97 35.02 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.271 -0.893 . . . . 0.0 111.047 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 m -89.96 144.68 25.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.8 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -76.14 111.17 11.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.006 0.432 . . . . 0.0 110.901 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.5 m -111.96 50.29 0.86 Allowed 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -20.5 130.35 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.333 0 CA-C-N 113.259 -1.791 . . . . 0.0 114.274 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.52 -6.96 47.99 Favored 'Cis proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.129 0.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -103.1 148.7 7.88 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-O 121.26 0.552 . . . . 0.0 112.318 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.5 m -86.59 133.55 33.71 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.857 -0.527 . . . . 0.0 109.966 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -135.17 144.77 47.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.276 0.56 . . . . 0.0 111.19 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.23 103.47 12.94 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.144 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.408 -178.701 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.434 0 CA-C-O 120.339 -0.145 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.58 112.86 59.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 117.128 0.464 . . . . 0.0 110.895 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.45 40.67 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.687 2.258 . . . . 0.0 112.609 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -96.91 34.41 1.72 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 28' ' ' LYS . 57.6 m -101.72 -38.26 7.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.91 37.28 56.89 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.55 ' OE1' ' HB3' ' A' ' 14' ' ' CYS . 55.0 tt0 -133.54 152.75 51.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.63 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.4 p -128.69 115.1 17.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.251 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.7 p -89.22 61.43 5.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.053 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.1 -36.85 71.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.938 0.399 . . . . 0.0 110.548 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.4 mt -83.78 -18.31 38.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.756 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.32 41.14 2.84 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.151 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.413 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 52.1 m -156.45 133.19 10.26 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.874 -0.191 . . . . 0.0 110.854 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.55 ' HB3' ' OE1' ' A' ' 7' ' ' GLU . 31.8 m -121.97 119.41 31.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.3 p90 -81.91 -20.24 39.16 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.487 -178.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.2 t -64.55 121.41 72.72 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.222 0.534 . . . . 0.0 110.818 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.74 133.43 44.75 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.434 2.756 . . . . 0.0 113.681 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.598 ' HB3' ' HD2' ' A' ' 28' ' ' LYS . 29.7 t70 71.52 -5.18 1.68 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.347 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 62.2 m -88.2 129.3 35.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.569 0.699 . . . . 0.0 110.915 179.126 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m -100.27 148.78 24.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.818 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.4 t -75.03 116.57 15.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.931 0.396 . . . . 0.0 110.823 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 50.5 m -121.0 49.48 1.48 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.8 t90 -19.29 129.92 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.4 0 O-C-N 125.569 1.793 . . . . 0.0 114.459 -177.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -81.84 -13.68 36.73 Favored 'Cis proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.174 -1.594 . . . . 0.0 114.827 0.023 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.3 mt -94.63 150.02 4.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 121.214 0.531 . . . . 0.0 112.25 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.8 m -92.78 128.5 38.66 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 121.798 -0.564 . . . . 0.0 110.337 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.528 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 53.4 mtt -118.49 135.07 54.59 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HD2' ' HB3' ' A' ' 18' ' ' ASP . 10.4 ttpp -89.19 99.81 12.72 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.432 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.344 -178.797 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 120.406 -0.108 . . . . 0.0 113.102 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.54 64.1 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.949 0.375 . . . . 0.0 110.885 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 83.1 Cg_endo -79.02 40.39 0.93 Allowed 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.748 2.299 . . . . 0.0 112.418 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -85.57 23.26 1.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.489 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.8 m -89.75 -33.76 16.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.08 39.29 73.39 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.403 ' OE1' HG23 ' A' ' 16' ' ' VAL . 59.6 tt0 -140.87 149.5 42.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.078 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -122.56 112.68 18.3 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.815 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.451 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.6 p -88.61 60.93 5.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.314 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.6 p -58.09 -35.08 70.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.997 0.427 . . . . 0.0 110.337 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.4 mt -82.08 -21.14 36.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.938 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.04 40.84 2.75 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.191 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.3 m -157.68 133.06 8.95 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.214 0.205 . . . . 0.0 110.477 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.3 m -118.17 119.98 36.35 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -81.38 -21.01 39.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.218 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.403 HG23 ' OE1' ' A' ' 7' ' ' GLU . 61.7 t -62.38 128.39 91.23 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -51.27 125.37 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 123.437 2.758 . . . . 0.0 114.25 -177.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.8 t0 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.484 -1.235 . . . . 0.0 113.082 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -89.2 126.63 35.57 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 111.114 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.9 m -90.41 143.43 26.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.908 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.0 t -75.98 109.66 9.79 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.048 0.451 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.567 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.7 m -111.38 50.47 0.83 Allowed 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -20.79 130.48 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.321 -176.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.57 -2.76 55.04 Favored 'Cis proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.242 -1.566 . . . . 0.0 115.066 0.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.7 mt -106.73 148.44 11.09 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 CA-C-O 121.215 0.531 . . . . 0.0 112.147 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.62 133.43 33.81 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 121.818 -0.551 . . . . 0.0 110.082 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.567 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.2 mtt -133.2 145.17 50.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 111.291 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.484 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.763 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.043 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.43 115.94 65.04 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 117.102 0.451 . . . . 0.0 110.92 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.6 Cg_endo -79.26 40.17 0.91 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.72 2.28 . . . . 0.0 112.451 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -84.59 22.36 1.32 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.575 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 65.1 m -89.66 -34.57 16.22 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.713 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 39.08 85.37 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.422 ' OE1' HG23 ' A' ' 16' ' ' VAL . 68.3 tt0 -135.89 150.82 49.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.264 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.9 108.17 13.13 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.814 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 13.6 p -89.04 61.52 5.89 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.346 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.468 HG23 HG22 ' A' ' 8' ' ' THR . 1.2 p -57.69 -35.56 70.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.044 0.449 . . . . 0.0 110.544 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -81.68 -20.23 39.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.037 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.83 41.26 2.92 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.114 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.6 m -156.11 132.55 10.16 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.9 m -118.3 120.11 36.64 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -81.18 -20.75 40.53 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.126 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.422 HG23 ' OE1' ' A' ' 7' ' ' GLU . 57.5 t -62.18 128.49 91.06 Favored Pre-proline 0 C--O 1.234 0.259 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -50.28 124.2 12.55 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 123.527 2.818 . . . . 0.0 114.342 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 63.04 13.33 6.66 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.448 -1.251 . . . . 0.0 113.084 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.0 m -89.5 126.98 35.8 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.262 -0.899 . . . . 0.0 111.254 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -90.04 143.73 26.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.607 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.7 t -78.09 105.5 9.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.915 0.388 . . . . 0.0 111.004 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.566 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.7 m -104.85 50.77 0.78 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.0 t90 -19.74 129.31 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 O-C-N 125.511 1.757 . . . . 0.0 114.351 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.37 -15.99 30.9 Favored 'Cis proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.905 -1.706 . . . . 0.0 115.06 0.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.5 mt -92.95 146.99 5.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 CA-C-O 121.535 0.683 . . . . 0.0 112.764 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.1 m -86.54 134.14 33.68 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.566 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.7 mtt -133.35 143.83 49.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 111.415 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.762 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 177.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 120.372 -0.127 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.62 114.7 61.59 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 117.14 0.47 . . . . 0.0 110.923 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 87.1 Cg_endo -79.61 40.27 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.716 2.278 . . . . 0.0 112.48 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.8 p -84.73 20.63 1.73 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.492 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.4 m -89.61 -35.8 15.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.808 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.52 37.89 90.15 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.512 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.64 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 20.2 tt0 -133.95 148.62 51.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' THR . 13.5 m -116.75 108.66 16.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.105 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 13' ' ' THR . 11.3 p -89.06 61.63 5.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.488 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.55 -36.14 71.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 0.0 110.598 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.67 -17.7 40.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.14 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.04 42.85 2.95 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.038 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.412 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 39.4 m -155.46 134.75 12.35 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.64 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 47.2 m -121.66 121.28 37.0 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -81.22 -24.42 37.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.233 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.572 HG23 ' OE1' ' A' ' 7' ' ' GLU . 97.1 t -60.55 125.87 83.46 Favored Pre-proline 0 C--O 1.233 0.225 0 CA-C-O 121.02 0.438 . . . . 0.0 110.373 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -43.69 123.61 3.93 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 123.958 3.106 . . . . 0.0 114.93 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.3 t0 60.94 13.58 4.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.463 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 m -88.71 125.44 34.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 121.327 -0.858 . . . . 0.0 111.308 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 m -89.97 142.26 27.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.521 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -74.8 115.23 14.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.408 . . . . 0.0 110.834 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.0 m -115.21 49.14 1.09 Allowed 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -17.64 129.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.318 0 CA-C-N 113.021 -1.899 . . . . 0.0 114.605 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.55 -18.54 24.47 Favored 'Cis proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.885 -1.714 . . . . 0.0 114.934 -0.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.7 mt -91.95 147.96 4.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.29 134.96 33.71 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.2 mtt -134.6 141.27 46.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.307 0.575 . . . . 0.0 111.217 -179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.32 -0.682 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.69 115.31 63.53 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 117.171 0.486 . . . . 0.0 110.782 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.428 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.4 Cg_endo -78.75 40.32 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.775 2.317 . . . . 0.0 112.687 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.1 p -84.7 27.92 0.7 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.382 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.6 m -96.68 -35.2 11.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.24 38.03 87.24 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.631 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -138.68 146.43 41.59 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.8 p -116.97 112.3 20.8 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.087 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.3 p -88.83 61.12 5.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.277 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.1 p -58.29 -35.09 71.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.068 0.461 . . . . 0.0 110.386 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.95 -21.02 34.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.005 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.95 42.51 2.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.253 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.407 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 37.2 m -157.6 135.15 10.51 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.631 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 55.6 m -121.13 120.97 36.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.5 -25.61 35.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.428 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.597 HG23 ' OE1' ' A' ' 7' ' ' GLU . 85.6 t -60.45 127.39 86.54 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.049 0.452 . . . . 0.0 110.44 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -43.43 123.4 3.57 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 124.021 3.147 . . . . 0.0 114.955 -178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.71 16.86 5.82 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.517 -1.219 . . . . 0.0 113.286 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.0 m -89.27 125.24 35.01 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.19 -0.944 . . . . 0.0 111.036 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -89.87 142.64 27.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.519 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -75.2 110.84 9.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.067 0.46 . . . . 0.0 111.07 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.564 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.7 m -111.97 49.79 0.89 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.9 t90 -19.87 130.57 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 CA-C-N 113.172 -1.831 . . . . 0.0 114.356 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.36 -2.9 54.31 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.227 -1.572 . . . . 0.0 115.139 0.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -107.25 148.35 11.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 CA-C-O 121.253 0.549 . . . . 0.0 112.08 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.41 134.27 33.72 Favored 'General case' 0 C--N 1.317 -0.837 0 O-C-N 121.798 -0.564 . . . . 0.0 110.254 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -134.92 143.72 47.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.214 0.531 . . . . 0.0 111.047 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.67 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.5 63.99 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 117.033 0.416 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -78.93 39.97 0.87 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.3 p -84.49 23.82 1.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.519 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 85.2 m -89.65 -33.59 16.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.601 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.23 37.57 86.77 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.521 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.637 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -135.1 147.53 49.56 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' THR . 14.8 m -117.4 108.37 15.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.005 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.3 p -88.89 61.5 5.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.382 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.496 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.89 -35.5 71.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.052 0.453 . . . . 0.0 110.455 178.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.68 -19.81 40.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.02 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.36 41.24 3.03 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.181 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.9 m -156.7 132.95 9.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.637 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 45.7 m -117.44 122.24 43.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -81.1 -24.68 37.54 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.123 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.581 HG23 ' OE1' ' A' ' 7' ' ' GLU . 92.0 t -60.25 127.61 86.46 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.55 127.92 26.09 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.352 2.701 . . . . 0.0 114.225 -177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.8 t0 65.23 9.08 5.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.148 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.8 m -89.11 125.49 35.05 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.444 -0.785 . . . . 0.0 111.261 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.8 m -90.25 141.19 28.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.722 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -75.94 112.57 12.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.002 0.429 . . . . 0.0 110.704 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.6 m -112.86 50.19 0.89 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 48.8 t90 -17.98 129.14 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.786 1.929 . . . . 0.0 114.539 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.475 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 90.0 Cg_endo -81.29 -16.88 28.81 Favored 'Cis proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.97 -1.679 . . . . 0.0 114.921 -0.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -93.13 147.88 5.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -86.87 134.92 33.49 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.0 mtt -131.13 144.47 51.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.291 0.567 . . . . 0.0 111.281 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 CA-C-O 120.399 -0.112 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.71 115.63 64.33 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 117.048 0.424 . . . . 0.0 110.885 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -79.27 41.25 1.06 Allowed 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.789 2.326 . . . . 0.0 112.401 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.9 p -84.08 22.04 1.26 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.476 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 66.7 m -89.75 -34.72 16.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.741 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.47 37.26 89.86 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.507 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.641 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.5 tt0 -134.2 147.79 50.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.489 HG22 HG23 ' A' ' 10' ' ' THR . 13.8 m -116.98 108.36 15.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.026 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.9 p -88.94 61.25 5.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.381 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.489 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.98 -35.4 71.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.063 0.458 . . . . 0.0 110.449 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.9 mt -81.86 -20.15 39.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.998 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.69 41.77 2.84 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.197 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.424 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 27.9 m -156.76 133.52 10.2 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.641 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.4 m -118.74 122.14 41.75 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -81.06 -24.86 37.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.607 HG23 ' OE1' ' A' ' 7' ' ' GLU . 99.2 t -59.74 128.17 86.17 Favored Pre-proline 0 C--O 1.233 0.221 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -51.68 126.89 20.99 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.542 2.828 . . . . 0.0 114.254 -177.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.0 t0 64.17 11.13 6.03 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 114.499 -1.228 . . . . 0.0 113.059 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 m -89.18 124.9 34.78 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.344 -0.848 . . . . 0.0 111.259 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -89.98 141.23 28.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.621 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.6 t -75.56 112.18 11.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.572 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 54.2 m -111.87 49.78 0.88 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -18.06 129.3 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 113.048 -1.887 . . . . 0.0 114.499 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.02 -17.22 27.96 Favored 'Cis proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.986 -1.673 . . . . 0.0 114.871 -0.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.4 mt -92.81 147.8 5.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.5 m -86.43 134.78 33.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.1 mtt -132.82 144.26 50.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.368 0.604 . . . . 0.0 111.249 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.721 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.338 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -93.48 118.25 67.53 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 117.222 0.511 . . . . 0.0 110.675 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -74.68 38.84 0.53 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.744 2.296 . . . . 0.0 112.924 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -81.73 52.42 1.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.007 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.5 m -140.06 -43.32 0.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.235 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.32 35.21 76.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.379 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.615 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 19.3 tt0 -121.92 149.3 43.62 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 HG23 ' A' ' 10' ' ' THR . 11.0 m -115.51 107.37 15.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.934 0.397 . . . . 0.0 110.366 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.404 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.3 p -89.17 61.39 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.207 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.518 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.39 -35.94 70.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.012 0.434 . . . . 0.0 110.577 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.13 -17.79 41.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.83 41.96 3.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.883 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.404 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.0 m -156.13 134.23 11.33 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.313 0.245 . . . . 0.0 110.353 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 36.4 m -118.9 121.02 39.01 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -81.06 -25.26 37.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.063 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.47 HG23 ' OE1' ' A' ' 7' ' ' GLU . 87.5 t -62.76 125.94 87.48 Favored Pre-proline 0 C--O 1.235 0.309 0 CA-C-O 121.028 0.442 . . . . 0.0 109.952 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.23 138.09 64.7 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.711 2.274 . . . . 0.0 112.831 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 33.2 t0 65.65 45.76 2.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.431 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.41 127.25 17.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.688 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -99.79 145.25 27.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.329 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -71.98 117.64 13.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.001 0.429 . . . . 0.0 110.671 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.537 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.2 m -117.93 47.1 1.63 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -16.47 129.06 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.773 1.921 . . . . 0.0 114.718 -176.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -79.55 -21.04 18.33 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.89 -1.713 . . . . 0.0 114.962 -0.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -90.38 148.35 4.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.605 0 CA-C-O 121.452 0.644 . . . . 0.0 112.579 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.4 m -86.24 131.08 34.31 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 121.944 -0.472 . . . . 0.0 109.729 178.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.537 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.4 mtm -134.43 142.53 47.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.353 0.597 . . . . 0.0 111.196 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt . . . . . 0 C--N 1.317 -0.842 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.871 178.289 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 CA-C-O 120.351 -0.138 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.56 114.46 60.63 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 117.124 0.462 . . . . 0.0 110.724 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.3 Cg_endo -76.29 37.89 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.662 2.241 . . . . 0.0 112.756 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -86.7 40.1 0.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.124 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.7 m -108.87 -34.55 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.665 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.7 41.4 56.7 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.627 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.8 tt0 -143.99 147.28 33.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.8 p -119.37 111.78 18.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.85 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 14.3 p -88.55 61.72 6.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.439 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.37 -34.0 70.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 110.43 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.4 mt -80.45 -22.22 41.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.948 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.13 39.07 3.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.273 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 23.0 m -158.9 130.91 6.6 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 122.296 0.238 . . . . 0.0 110.391 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.627 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 58.2 m -111.85 121.78 45.99 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -81.25 -25.75 36.36 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.501 HG23 ' OE1' ' A' ' 7' ' ' GLU . 74.5 t -62.19 124.35 81.9 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 121.073 0.463 . . . . 0.0 109.911 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.85 138.69 64.52 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.642 2.228 . . . . 0.0 112.618 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.5 t0 66.85 45.55 1.84 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.403 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.8 m -145.02 130.38 18.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m -97.61 148.63 23.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.523 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -79.75 103.79 9.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.936 0.398 . . . . 0.0 111.056 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.561 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.0 m -104.23 52.17 0.76 Allowed 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 178.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 58.5 t90 -22.01 130.3 0.07 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 125.278 1.611 . . . . 0.0 114.142 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -84.75 1.57 62.25 Favored 'Cis proline' 0 C--N 1.346 0.405 0 C-N-CA 123.235 -1.569 . . . . 0.0 115.134 0.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.6 mt -110.5 146.84 15.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 112.182 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.7 m -85.43 132.44 34.22 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 121.805 -0.559 . . . . 0.0 110.161 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.1 mtt -133.43 144.54 49.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.173 0.511 . . . . 0.0 111.057 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt . . . . . 0 C--N 1.318 -0.774 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.016 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -92.73 116.44 66.5 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 117.196 0.498 . . . . 0.0 110.936 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -78.86 40.25 0.91 Allowed 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.776 2.318 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.6 p -85.79 21.93 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.467 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.4 m -89.65 -34.49 16.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.63 37.51 89.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.193 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -138.24 146.68 42.87 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -117.12 112.53 21.0 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.9 p -88.81 60.65 5.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.9 p -58.15 -35.02 70.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.004 0.43 . . . . 0.0 110.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -20.56 34.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.976 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.55 42.16 2.58 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.213 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.4 m -157.93 134.91 9.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.9 m -120.33 120.92 37.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -81.25 -25.67 36.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.492 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.587 HG23 ' OE1' ' A' ' 7' ' ' GLU . 89.2 t -60.37 126.97 85.76 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 121.022 0.439 . . . . 0.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -43.55 123.93 3.96 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.957 3.104 . . . . 0.0 114.869 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 60.27 15.87 5.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.399 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.3 m -89.24 124.81 34.72 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 121.185 -0.947 . . . . 0.0 110.973 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m -89.79 141.48 28.58 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.617 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -73.97 114.47 12.33 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.16 0.505 . . . . 0.0 110.942 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.7 m -115.52 48.54 1.18 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.47 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 51.3 t90 -18.94 130.01 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 125.553 1.783 . . . . 0.0 114.443 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 97.2 Cg_endo -82.97 -5.03 51.29 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.168 -1.597 . . . . 0.0 115.15 0.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mt -105.39 149.0 9.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 CA-C-O 121.144 0.497 . . . . 0.0 112.097 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 68.3 m -88.07 133.39 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.737 -0.602 . . . . 0.0 110.347 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -132.97 142.15 48.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.282 0.563 . . . . 0.0 111.205 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.318 -0.786 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 120.501 -0.055 . . . . 0.0 113.083 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.56 115.84 65.28 Favored Pre-proline 0 C--N 1.328 -0.341 0 O-C-N 122.492 -0.417 . . . . 0.0 110.699 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 27' ' ' MET . 74.5 Cg_endo -75.86 36.97 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.624 2.216 . . . . 0.0 112.555 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -86.18 42.05 0.97 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.7 m -111.45 -35.49 5.8 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.482 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.0 42.21 69.17 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.429 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -138.55 151.49 47.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.841 0.353 . . . . 0.0 110.465 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.479 HG22 HG23 ' A' ' 10' ' ' THR . 18.7 m -122.42 109.08 13.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.729 -0.668 . . . . 0.0 109.57 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.5 p -88.81 61.57 6.03 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.423 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.479 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.86 71.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.096 0.474 . . . . 0.0 110.452 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.3 mt -81.84 -20.94 37.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.986 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.79 41.38 2.69 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.001 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 54.2 m -156.46 134.32 11.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 45.3 m -120.22 119.08 32.19 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -81.61 -20.53 39.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.955 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.38 129.61 92.58 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.829 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -47.71 134.0 22.0 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 123.71 2.94 . . . . 0.0 113.967 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.586 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 44.79 34.08 1.11 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.334 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.7 m -108.45 128.33 54.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.172 0.511 . . . . 0.0 110.561 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -92.46 143.92 25.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.871 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.0 t -75.19 110.72 9.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.947 0.403 . . . . 0.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 52.0 m -111.52 49.78 0.87 Allowed 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.68 128.65 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.256 0 O-C-N 125.651 1.844 . . . . 0.0 114.451 -176.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -81.22 -19.4 22.58 Favored 'Cis proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.783 -1.757 . . . . 0.0 114.836 -0.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.2 mt -88.67 148.03 4.82 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-O 121.441 0.639 . . . . 0.0 112.713 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.2 m -89.42 132.84 34.8 Favored 'General case' 0 C--N 1.318 -0.764 0 O-C-N 122.017 -0.427 . . . . 0.0 109.945 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.7 mtt -128.14 141.84 51.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 110.754 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 8.3 ttpt . . . . . 0 C--N 1.316 -0.887 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 CA-C-O 120.418 -0.101 . . . . 0.0 113.17 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.74 115.6 64.27 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 117.133 0.466 . . . . 0.0 110.859 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.6 Cg_endo -78.89 40.57 0.95 Allowed 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.699 2.266 . . . . 0.0 112.591 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.3 p -85.07 29.92 0.62 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.358 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.4 m -99.36 -35.36 9.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.969 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.85 38.72 75.99 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -138.79 151.92 47.46 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.079 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 t -125.08 114.51 19.16 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.44 0.638 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.4 p -89.5 60.73 5.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.263 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.19 -36.43 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.078 0.466 . . . . 0.0 110.497 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.73 -19.8 37.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.96 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.46 41.98 2.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.235 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.5 m -156.97 134.13 10.43 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.5 m -120.46 119.15 32.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -81.46 -20.72 39.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.327 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.7 t -63.23 126.25 88.8 Favored Pre-proline 0 C--O 1.233 0.233 0 CA-C-O 121.0 0.429 . . . . 0.0 110.349 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -43.99 122.53 3.56 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.946 3.098 . . . . 0.0 114.842 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.2 t0 61.48 13.19 4.9 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.4 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 21.2 m -88.74 127.39 35.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.356 -0.84 . . . . 0.0 111.089 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -91.02 144.08 26.03 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.872 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.403 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.1 t -75.06 111.14 9.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.045 0.45 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 57.5 m -112.54 50.07 0.89 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.7 t90 -20.57 130.1 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 113.321 -1.763 . . . . 0.0 114.297 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.46 -8.6 45.95 Favored 'Cis proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.042 0.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.1 mt -100.76 148.74 6.67 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.72 133.17 33.9 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 121.822 -0.548 . . . . 0.0 109.764 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 48.1 mtt -134.89 145.66 48.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.255 0.55 . . . . 0.0 111.314 -178.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.725 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 120.325 -0.153 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -97.53 119.56 62.5 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 117.157 0.479 . . . . 0.0 110.567 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.24 36.07 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.703 2.269 . . . . 0.0 112.738 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -84.77 49.34 1.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.831 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 58.6 m -125.29 -37.72 2.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.552 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.34 42.18 75.46 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.519 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -135.81 152.16 50.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.889 0.376 . . . . 0.0 110.27 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.48 HG22 HG23 ' A' ' 10' ' ' THR . 18.3 m -122.66 109.98 14.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.744 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.1 p -88.97 61.61 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.331 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.48 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.55 -36.49 71.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.7 mt -82.72 -19.26 38.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.095 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 42.0 2.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.02 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.0 m -156.17 135.18 11.98 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 38.4 m -121.95 118.69 29.46 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -81.67 -20.46 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.178 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 99.1 t -64.02 128.34 92.89 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.504 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_exo -40.68 129.79 2.67 Favored 'Trans proline' 0 C--O 1.237 0.449 0 C-N-CA 124.077 3.185 . . . . 0.0 114.719 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.538 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 43.76 30.78 0.4 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.76 179.257 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 m -101.29 125.65 47.94 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.197 0.523 . . . . 0.0 110.408 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 m -90.04 143.49 26.73 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.851 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.2 t -72.99 114.91 11.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.959 0.409 . . . . 0.0 110.664 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.534 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 67.6 m -115.31 48.0 1.24 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.3 t90 -17.99 128.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 125.647 1.842 . . . . 0.0 114.434 -176.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -80.34 -22.57 15.68 Favored 'Cis proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.737 -1.776 . . . . 0.0 114.82 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.9 148.83 4.47 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 CA-C-O 121.454 0.645 . . . . 0.0 112.666 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.4 m -90.41 131.73 36.01 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.886 -0.509 . . . . 0.0 110.004 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 43.6 mtm -129.6 140.1 51.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.431 0.634 . . . . 0.0 110.692 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 11.6 ttpt . . . . . 0 C--N 1.314 -0.959 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.939 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-O 120.277 -0.18 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 113.74 58.14 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 117.273 0.536 . . . . 0.0 110.929 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.438 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.1 Cg_endo -76.48 38.59 0.62 Allowed 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.708 2.272 . . . . 0.0 112.837 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -89.85 35.8 0.85 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.29 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.0 m -102.73 -34.55 8.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.72 40.49 65.37 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.703 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.613 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.9 tt0 -142.04 147.42 36.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.9 p -118.71 112.75 20.17 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.136 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.416 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.6 p -88.7 62.34 6.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.246 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -58.27 -35.01 71.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.069 0.461 . . . . 0.0 110.493 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.6 mt -83.12 -17.66 42.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.025 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.44 40.64 3.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.068 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 22.9 m -157.77 132.3 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.352 0.261 . . . . 0.0 110.353 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.613 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 56.0 m -115.47 120.25 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.9 p90 -81.14 -26.14 36.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.076 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 71.5 t -62.27 118.92 44.72 Favored Pre-proline 0 C--O 1.235 0.296 0 CA-C-O 121.146 0.498 . . . . 0.0 110.513 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -56.0 137.87 80.52 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.116 2.544 . . . . 0.0 112.805 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 42.1 t0 66.12 45.12 2.43 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.498 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 38.9 m -143.92 130.55 20.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.224 0.535 . . . . 0.0 110.81 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.0 m -99.85 146.95 26.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.637 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.55 115.34 16.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.033 0.444 . . . . 0.0 110.959 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -117.47 50.39 1.12 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -19.94 130.72 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.417 0 CA-C-N 113.21 -1.814 . . . . 0.0 114.4 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.03 -4.31 52.11 Favored 'Cis proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.266 -1.556 . . . . 0.0 115.074 0.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 32.2 mt -106.26 148.7 10.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 CA-C-O 121.265 0.555 . . . . 0.0 112.156 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.24 134.61 33.52 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.865 -0.522 . . . . 0.0 110.254 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.9 mtt -132.07 143.04 49.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.24 0.543 . . . . 0.0 111.019 -179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 ttpt . . . . . 0 C--N 1.318 -0.78 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.208 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -94.07 117.19 67.14 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 117.2 0.5 . . . . 0.0 110.916 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.59 40.48 0.92 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.883 2.389 . . . . 0.0 112.413 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.9 p -86.61 22.7 1.83 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.498 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.1 m -89.62 -34.12 16.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.833 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.4 38.82 70.28 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -139.93 152.53 46.45 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.078 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.3 t -126.29 114.84 18.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.453 0.644 . . . . 0.0 109.759 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.45 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 10.3 p -89.49 60.75 5.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.212 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.0 p -57.24 -36.31 70.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.152 0.501 . . . . 0.0 110.428 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.93 -19.13 41.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.982 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.66 40.5 3.14 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.038 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.2 m -157.51 132.7 8.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 122.17 0.188 . . . . 0.0 110.524 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 53.6 m -117.12 120.26 37.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -81.41 -20.64 39.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.167 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.69 126.67 88.97 Favored Pre-proline 0 C--O 1.233 0.2 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -53.16 127.61 25.78 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.322 2.682 . . . . 0.0 114.013 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.9 t0 66.97 5.48 4.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.604 -1.18 . . . . 0.0 113.134 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.9 m -88.39 129.01 35.52 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 121.488 -0.757 . . . . 0.0 111.186 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.31 143.45 26.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.056 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.445 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t -74.51 115.4 14.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.065 0.46 . . . . 0.0 110.798 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.583 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 60.8 m -117.28 49.51 1.19 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -20.04 129.72 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 125.46 1.725 . . . . 0.0 114.255 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.78 -11.97 40.09 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.105 -1.623 . . . . 0.0 115.174 0.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 31.1 mt -98.24 149.82 5.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.62 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.42 132.27 35.08 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.712 -0.617 . . . . 0.0 109.775 178.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.583 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -131.44 144.21 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.455 0.645 . . . . 0.0 111.539 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-O 120.276 -0.18 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -95.16 116.63 66.52 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 117.237 0.518 . . . . 0.0 110.813 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.43 38.19 0.54 Allowed 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.736 2.291 . . . . 0.0 112.871 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -88.69 40.47 0.97 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.232 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 76.1 m -110.95 -34.57 6.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.694 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.33 42.07 66.48 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.995 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.3 tt0 -143.02 147.42 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.6 p -118.76 112.46 19.77 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.067 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.408 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.68 62.06 6.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.162 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.19 -34.7 70.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.088 0.471 . . . . 0.0 110.509 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.1 mt -82.73 -19.2 38.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.91 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.88 40.26 3.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.093 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.4 m -158.29 132.01 7.75 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 122.346 0.258 . . . . 0.0 110.363 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.622 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.7 m -113.89 121.45 44.0 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -81.1 -25.26 37.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.983 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 75.7 t -62.5 124.69 83.8 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.065 0.459 . . . . 0.0 109.834 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.53 138.17 63.59 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.644 2.23 . . . . 0.0 112.746 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 20.1 t0 66.59 44.52 2.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.592 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 m -143.03 130.55 21.19 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.612 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -99.29 145.8 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.864 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.93 116.22 15.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.047 0.451 . . . . 0.0 110.678 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 65.4 m -117.92 49.45 1.24 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -19.25 130.08 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 114.428 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.96 -5.16 51.12 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.195 -1.585 . . . . 0.0 115.123 0.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.2 mt -105.53 148.97 9.32 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 CA-C-O 121.179 0.514 . . . . 0.0 112.113 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.1 m -87.85 132.18 34.28 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 121.773 -0.579 . . . . 0.0 110.271 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.1 mtm -129.87 141.82 50.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.492 0.663 . . . . 0.0 110.999 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 4.3 ttpt . . . . . 0 C--N 1.317 -0.818 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.845 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.75 115.13 63.1 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 117.165 0.483 . . . . 0.0 111.002 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.518 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.9 Cg_endo -79.19 39.63 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.768 2.312 . . . . 0.0 112.302 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -85.03 24.16 1.12 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.534 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 82.7 m -89.71 -32.88 16.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.685 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.79 40.77 89.66 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.251 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.6 tt0 -140.4 150.34 43.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.478 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.42 109.64 15.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.286 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.422 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.83 62.34 6.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.478 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.47 70.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.02 0.438 . . . . 0.0 110.617 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.7 mt -81.29 -20.07 41.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.954 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.42 40.26 3.25 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.08 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 29.7 m -157.75 129.28 6.8 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 122.219 0.208 . . . . 0.0 110.498 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.591 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 26.7 m -113.56 123.35 49.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -81.43 -23.0 37.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 ' OE2' ' A' ' 7' ' ' GLU . 59.9 t -58.78 127.29 82.58 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.734 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.31 128.3 29.44 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.369 2.712 . . . . 0.0 114.288 -178.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t0 64.99 6.77 3.6 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.581 -1.19 . . . . 0.0 113.307 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -88.71 126.24 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.612 -0.68 . . . . 0.0 111.262 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.67 140.23 29.96 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.684 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.7 t -74.77 114.2 12.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.051 0.453 . . . . 0.0 110.629 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -114.51 49.98 0.99 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.471 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 49.3 t90 -18.14 129.14 0.04 OUTLIER Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 113.139 -1.846 . . . . 0.0 114.486 -176.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 83.3 Cg_endo -80.63 -18.71 24.09 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 C-N-CA 122.893 -1.711 . . . . 0.0 115.016 0.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.3 mt -91.98 147.72 5.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -87.18 134.34 33.54 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -131.49 143.12 50.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.346 0.593 . . . . 0.0 111.307 -179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.358 -0.134 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.86 115.25 63.44 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 117.075 0.437 . . . . 0.0 110.918 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.537 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 79.4 Cg_endo -79.22 39.55 0.83 Allowed 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.735 2.29 . . . . 0.0 112.38 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.6 p -85.48 25.86 0.99 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.427 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.5 m -89.74 -32.94 16.76 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.925 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.84 41.55 82.29 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.18 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.597 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.7 tt0 -142.18 155.01 45.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.483 HG22 HG23 ' A' ' 10' ' ' THR . 25.0 m -126.89 110.11 12.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.33 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 13' ' ' THR . 9.5 p -88.93 62.89 6.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.301 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.483 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -58.01 -35.77 71.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.004 0.431 . . . . 0.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -81.18 -20.14 41.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.952 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.29 39.78 3.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.42 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.1 m -157.66 129.1 6.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 122.238 0.215 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 29.7 m -112.65 123.52 50.49 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -81.34 -23.55 37.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.52 HG23 ' OE2' ' A' ' 7' ' ' GLU . 62.5 t -58.23 126.74 79.06 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.686 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.73 129.41 34.88 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.344 2.696 . . . . 0.0 114.338 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.6 t0 65.3 5.09 2.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.559 -1.201 . . . . 0.0 113.429 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.3 m -88.3 126.78 35.35 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.55 -0.719 . . . . 0.0 111.29 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.7 140.07 30.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.704 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.7 115.66 14.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.035 0.445 . . . . 0.0 110.712 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 62.4 m -116.07 49.98 1.07 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 178.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.472 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.5 t90 -17.77 128.76 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 113.059 -1.882 . . . . 0.0 114.51 -176.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 85.1 Cg_endo -81.27 -18.85 23.95 Favored 'Cis proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.889 -1.713 . . . . 0.0 114.866 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.5 mt -90.75 147.87 4.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.0 m -88.02 134.45 33.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.8 mtt -130.88 142.8 50.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.311 0.577 . . . . 0.0 111.419 -179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-O 120.36 -0.133 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.73 115.11 63.06 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 117.107 0.454 . . . . 0.0 110.9 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.5 Cg_endo -79.22 40.12 0.9 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.716 2.277 . . . . 0.0 112.405 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.1 p -85.78 23.14 1.48 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.472 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.0 m -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.84 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.45 38.25 79.76 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.643 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -139.98 148.84 42.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -120.99 114.2 21.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.31 0.576 . . . . 0.0 110.002 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.2 p -89.6 60.17 5.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.285 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.2 p -57.64 -35.81 71.0 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.119 0.485 . . . . 0.0 110.379 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.0 mt -81.62 -21.08 38.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.918 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.35 41.58 2.54 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.199 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.5 m -157.96 133.77 9.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.242 0.217 . . . . 0.0 110.468 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.643 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.4 m -118.59 121.06 39.3 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -81.19 -25.64 36.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.346 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.575 HG23 ' OE1' ' A' ' 7' ' ' GLU . 95.4 t -60.3 124.29 77.24 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-O 121.067 0.46 . . . . 0.0 110.422 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -45.65 126.37 8.77 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.824 3.016 . . . . 0.0 114.691 -178.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.2 t0 63.64 8.89 3.94 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.511 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -88.33 126.49 35.22 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.374 -0.829 . . . . 0.0 111.175 179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.5 m -90.21 144.41 25.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.797 -179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.402 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.2 t -76.65 111.94 12.69 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.028 0.442 . . . . 0.0 110.977 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.562 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.9 m -112.96 50.65 0.87 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -20.69 130.44 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.304 0 CA-C-N 113.277 -1.783 . . . . 0.0 114.284 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -82.57 -6.95 48.12 Favored 'Cis proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.094 -1.628 . . . . 0.0 115.086 0.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.3 mt -103.4 148.55 8.27 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 CA-C-O 121.258 0.551 . . . . 0.0 112.381 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -86.55 133.61 33.71 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 121.86 -0.525 . . . . 0.0 109.889 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.562 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -134.03 142.92 47.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 111.249 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.534 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.752 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.395 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.155 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.72 115.94 65.12 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 117.074 0.437 . . . . 0.0 110.793 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.411 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.1 Cg_endo -78.69 40.34 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.688 2.259 . . . . 0.0 112.57 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.4 p -84.66 31.85 0.52 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.285 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.67 -35.39 9.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.922 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 38.54 84.82 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.234 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.645 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.0 tt0 -139.46 148.99 43.48 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 t -120.88 114.44 21.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.421 0.629 . . . . 0.0 109.871 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.7 p -89.58 60.47 5.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.268 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -57.46 -36.12 71.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.107 0.48 . . . . 0.0 110.452 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.24 -20.85 36.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.925 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.42 42.12 2.42 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.291 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.4 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 36.0 m -157.52 134.32 10.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.421 -0.215 . . . . 0.0 110.421 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.645 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.2 m -119.89 120.85 37.62 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.38 -25.4 36.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.302 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.591 HG23 ' OE1' ' A' ' 7' ' ' GLU . 98.3 t -60.15 125.1 80.38 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.072 0.463 . . . . 0.0 110.429 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.96 125.31 6.56 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 123.903 3.068 . . . . 0.0 114.779 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.1 t0 62.55 10.76 4.27 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.551 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.9 m -88.5 125.97 35.02 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.271 -0.893 . . . . 0.0 111.047 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 m -89.96 144.68 25.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.8 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -76.14 111.17 11.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.006 0.432 . . . . 0.0 110.901 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.5 m -111.96 50.29 0.86 Allowed 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -20.5 130.35 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.333 0 CA-C-N 113.259 -1.791 . . . . 0.0 114.274 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.52 -6.96 47.99 Favored 'Cis proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.129 0.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -103.1 148.7 7.88 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-O 121.26 0.552 . . . . 0.0 112.318 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.5 m -86.59 133.55 33.71 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.857 -0.527 . . . . 0.0 109.966 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -135.17 144.77 47.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.276 0.56 . . . . 0.0 111.19 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.548 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.319 -0.735 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.434 0 CA-C-O 120.339 -0.145 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.58 112.86 59.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 117.128 0.464 . . . . 0.0 110.895 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.45 40.67 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.687 2.258 . . . . 0.0 112.609 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -96.91 34.41 1.72 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 28' ' ' LYS . 57.6 m -101.72 -38.26 7.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.91 37.28 56.89 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.55 ' OE1' ' HB3' ' A' ' 14' ' ' CYS . 55.0 tt0 -133.54 152.75 51.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.63 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.4 p -128.69 115.1 17.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.251 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.7 p -89.22 61.43 5.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.053 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.1 -36.85 71.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.938 0.399 . . . . 0.0 110.548 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.4 mt -83.78 -18.31 38.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.756 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.32 41.14 2.84 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.151 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.413 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 52.1 m -156.45 133.19 10.26 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.874 -0.191 . . . . 0.0 110.854 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.55 ' HB3' ' OE1' ' A' ' 7' ' ' GLU . 31.8 m -121.97 119.41 31.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.3 p90 -81.91 -20.24 39.16 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.487 -178.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.2 t -64.55 121.41 72.72 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.222 0.534 . . . . 0.0 110.818 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.74 133.43 44.75 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.434 2.756 . . . . 0.0 113.681 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.598 ' HB3' ' HD2' ' A' ' 28' ' ' LYS . 29.7 t70 71.52 -5.18 1.68 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.347 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 62.2 m -88.2 129.3 35.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.569 0.699 . . . . 0.0 110.915 179.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m -100.27 148.78 24.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.818 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.4 t -75.03 116.57 15.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.931 0.396 . . . . 0.0 110.823 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 50.5 m -121.0 49.48 1.48 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.8 t90 -19.29 129.92 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.4 0 O-C-N 125.569 1.793 . . . . 0.0 114.459 -177.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -81.84 -13.68 36.73 Favored 'Cis proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.174 -1.594 . . . . 0.0 114.827 0.023 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.3 mt -94.63 150.02 4.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 121.214 0.531 . . . . 0.0 112.25 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.8 m -92.78 128.5 38.66 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 121.798 -0.564 . . . . 0.0 110.337 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.528 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 53.4 mtt -118.49 135.07 54.59 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HD2' ' HB3' ' A' ' 18' ' ' ASP . 10.4 ttpp . . . . . 0 C--N 1.307 -1.25 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.432 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 120.406 -0.108 . . . . 0.0 113.102 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.54 64.1 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.949 0.375 . . . . 0.0 110.885 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 83.1 Cg_endo -79.02 40.39 0.93 Allowed 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.748 2.299 . . . . 0.0 112.418 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -85.57 23.26 1.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.489 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.8 m -89.75 -33.76 16.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.08 39.29 73.39 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.403 ' OE1' HG23 ' A' ' 16' ' ' VAL . 59.6 tt0 -140.87 149.5 42.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.375 -0.412 . . . . 0.0 110.078 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -122.56 112.68 18.3 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.815 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.451 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.6 p -88.61 60.93 5.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.314 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.6 p -58.09 -35.08 70.88 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.997 0.427 . . . . 0.0 110.337 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.4 mt -82.08 -21.14 36.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.938 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.04 40.84 2.75 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.191 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.3 m -157.68 133.06 8.95 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.214 0.205 . . . . 0.0 110.477 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.3 m -118.17 119.98 36.35 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -81.38 -21.01 39.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.218 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.403 HG23 ' OE1' ' A' ' 7' ' ' GLU . 61.7 t -62.38 128.39 91.23 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -51.27 125.37 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 123.437 2.758 . . . . 0.0 114.25 -177.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.8 t0 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.484 -1.235 . . . . 0.0 113.082 178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -89.2 126.63 35.57 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.385 -0.822 . . . . 0.0 111.114 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.9 m -90.41 143.43 26.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.908 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.0 t -75.98 109.66 9.79 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.048 0.451 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.567 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.7 m -111.38 50.47 0.83 Allowed 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -20.79 130.48 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.321 -176.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.57 -2.76 55.04 Favored 'Cis proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.242 -1.566 . . . . 0.0 115.066 0.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.7 mt -106.73 148.44 11.09 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 CA-C-O 121.215 0.531 . . . . 0.0 112.147 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.62 133.43 33.81 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 121.818 -0.551 . . . . 0.0 110.082 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.567 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.2 mtt -133.2 145.17 50.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 111.291 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.484 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -108.16 104.22 13.59 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.401 ' CG ' ' HE2' ' A' ' 28' ' ' LYS . 71.3 m-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.314 -178.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.043 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.43 115.94 65.04 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 117.102 0.451 . . . . 0.0 110.92 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.6 Cg_endo -79.26 40.17 0.91 Allowed 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.72 2.28 . . . . 0.0 112.451 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -84.59 22.36 1.32 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.575 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 65.1 m -89.66 -34.57 16.22 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.713 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 39.08 85.37 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.422 ' OE1' HG23 ' A' ' 16' ' ' VAL . 68.3 tt0 -135.89 150.82 49.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.264 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.9 108.17 13.13 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.814 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 13.6 p -89.04 61.52 5.89 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.346 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.468 HG23 HG22 ' A' ' 8' ' ' THR . 1.2 p -57.69 -35.56 70.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.044 0.449 . . . . 0.0 110.544 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -81.68 -20.23 39.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.037 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.83 41.26 2.92 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.114 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 45.6 m -156.11 132.55 10.16 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.9 m -118.3 120.11 36.64 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -81.18 -20.75 40.53 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.126 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.422 HG23 ' OE1' ' A' ' 7' ' ' GLU . 57.5 t -62.18 128.49 91.06 Favored Pre-proline 0 C--O 1.234 0.259 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -50.28 124.2 12.55 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 123.527 2.818 . . . . 0.0 114.342 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 63.04 13.33 6.66 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.448 -1.251 . . . . 0.0 113.084 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.0 m -89.5 126.98 35.8 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.262 -0.899 . . . . 0.0 111.254 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -90.04 143.73 26.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.607 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.7 t -78.09 105.5 9.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.915 0.388 . . . . 0.0 111.004 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.566 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.7 m -104.85 50.77 0.78 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.0 t90 -19.74 129.31 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 O-C-N 125.511 1.757 . . . . 0.0 114.351 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.37 -15.99 30.9 Favored 'Cis proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.905 -1.706 . . . . 0.0 115.06 0.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.5 mt -92.95 146.99 5.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 CA-C-O 121.535 0.683 . . . . 0.0 112.764 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.1 m -86.54 134.14 33.68 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.566 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.7 mtt -133.35 143.83 49.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 111.415 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -106.98 104.67 14.4 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 177.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.409 ' CG ' ' HE2' ' A' ' 28' ' ' LYS . 72.4 m-20 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.349 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 120.372 -0.127 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.62 114.7 61.59 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 117.14 0.47 . . . . 0.0 110.923 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 87.1 Cg_endo -79.61 40.27 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.716 2.278 . . . . 0.0 112.48 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.8 p -84.73 20.63 1.73 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.492 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.4 m -89.61 -35.8 15.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.808 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.52 37.89 90.15 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.512 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.64 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 20.2 tt0 -133.95 148.62 51.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' THR . 13.5 m -116.75 108.66 16.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.105 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 13' ' ' THR . 11.3 p -89.06 61.63 5.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.488 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.55 -36.14 71.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 0.0 110.598 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.67 -17.7 40.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.14 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.04 42.85 2.95 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.038 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.412 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 39.4 m -155.46 134.75 12.35 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.64 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 47.2 m -121.66 121.28 37.0 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -81.22 -24.42 37.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.233 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.572 HG23 ' OE1' ' A' ' 7' ' ' GLU . 97.1 t -60.55 125.87 83.46 Favored Pre-proline 0 C--O 1.233 0.225 0 CA-C-O 121.02 0.438 . . . . 0.0 110.373 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -43.69 123.61 3.93 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 123.958 3.106 . . . . 0.0 114.93 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.3 t0 60.94 13.58 4.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 114.684 -1.144 . . . . 0.0 113.463 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 m -88.71 125.44 34.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 121.327 -0.858 . . . . 0.0 111.308 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 m -89.97 142.26 27.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.521 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -74.8 115.23 14.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.408 . . . . 0.0 110.834 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 66.0 m -115.21 49.14 1.09 Allowed 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -17.64 129.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.318 0 CA-C-N 113.021 -1.899 . . . . 0.0 114.605 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.55 -18.54 24.47 Favored 'Cis proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.885 -1.714 . . . . 0.0 114.934 -0.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.7 mt -91.95 147.96 4.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.29 134.96 33.71 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.2 mtt -134.6 141.27 46.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.307 0.575 . . . . 0.0 111.217 -179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -102.78 103.48 13.7 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.45 -178.659 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.69 115.31 63.53 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 117.171 0.486 . . . . 0.0 110.782 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.428 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.4 Cg_endo -78.75 40.32 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.775 2.317 . . . . 0.0 112.687 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.1 p -84.7 27.92 0.7 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.382 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.6 m -96.68 -35.2 11.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.24 38.03 87.24 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.631 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -138.68 146.43 41.59 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.8 p -116.97 112.3 20.8 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.087 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 15.3 p -88.83 61.12 5.82 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.277 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.1 p -58.29 -35.09 71.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.068 0.461 . . . . 0.0 110.386 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.95 -21.02 34.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.005 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.95 42.51 2.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.253 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.407 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 37.2 m -157.6 135.15 10.51 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.631 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 55.6 m -121.13 120.97 36.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.5 -25.61 35.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.428 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.597 HG23 ' OE1' ' A' ' 7' ' ' GLU . 85.6 t -60.45 127.39 86.54 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.049 0.452 . . . . 0.0 110.44 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -43.43 123.4 3.57 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 124.021 3.147 . . . . 0.0 114.955 -178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.71 16.86 5.82 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.517 -1.219 . . . . 0.0 113.286 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.0 m -89.27 125.24 35.01 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.19 -0.944 . . . . 0.0 111.036 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 m -89.87 142.64 27.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.519 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -75.2 110.84 9.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.067 0.46 . . . . 0.0 111.07 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.564 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.7 m -111.97 49.79 0.89 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.9 t90 -19.87 130.57 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 CA-C-N 113.172 -1.831 . . . . 0.0 114.356 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.36 -2.9 54.31 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.227 -1.572 . . . . 0.0 115.139 0.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -107.25 148.35 11.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 CA-C-O 121.253 0.549 . . . . 0.0 112.08 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.8 m -86.41 134.27 33.72 Favored 'General case' 0 C--N 1.317 -0.837 0 O-C-N 121.798 -0.564 . . . . 0.0 110.254 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -134.92 143.72 47.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.214 0.531 . . . . 0.0 111.047 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -105.88 103.23 12.68 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.135 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.415 -178.58 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.66 115.5 63.99 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 117.033 0.416 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -78.93 39.97 0.87 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.3 p -84.49 23.82 1.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.519 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 85.2 m -89.65 -33.59 16.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.601 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.23 37.57 86.77 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.521 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.637 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -135.1 147.53 49.56 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' THR . 14.8 m -117.4 108.37 15.48 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.005 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.429 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.3 p -88.89 61.5 5.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.382 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.496 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.89 -35.5 71.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.052 0.453 . . . . 0.0 110.455 178.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.68 -19.81 40.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.02 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.36 41.24 3.03 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.181 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.9 m -156.7 132.95 9.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.637 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 45.7 m -117.44 122.24 43.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -81.1 -24.68 37.54 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.123 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.581 HG23 ' OE1' ' A' ' 7' ' ' GLU . 92.0 t -60.25 127.61 86.46 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.55 127.92 26.09 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.352 2.701 . . . . 0.0 114.225 -177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.8 t0 65.23 9.08 5.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.148 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.8 m -89.11 125.49 35.05 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.444 -0.785 . . . . 0.0 111.261 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.8 m -90.25 141.19 28.96 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.722 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -75.94 112.57 12.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.002 0.429 . . . . 0.0 110.704 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.573 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 51.6 m -112.86 50.19 0.89 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 48.8 t90 -17.98 129.14 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.786 1.929 . . . . 0.0 114.539 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.475 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 90.0 Cg_endo -81.29 -16.88 28.81 Favored 'Cis proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.97 -1.679 . . . . 0.0 114.921 -0.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -93.13 147.88 5.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -86.87 134.92 33.49 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.0 mtt -131.13 144.47 51.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.291 0.567 . . . . 0.0 111.281 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -109.98 103.95 12.78 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.373 -178.355 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 CA-C-O 120.399 -0.112 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.71 115.63 64.33 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 117.048 0.424 . . . . 0.0 110.885 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.8 Cg_endo -79.27 41.25 1.06 Allowed 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.789 2.326 . . . . 0.0 112.401 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.9 p -84.08 22.04 1.26 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.476 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 66.7 m -89.75 -34.72 16.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.741 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.47 37.26 89.86 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.507 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.641 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.5 tt0 -134.2 147.79 50.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.489 HG22 HG23 ' A' ' 10' ' ' THR . 13.8 m -116.98 108.36 15.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.026 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB2' ' H ' ' A' ' 13' ' ' THR . 12.9 p -88.94 61.25 5.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.381 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.489 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.98 -35.4 71.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.063 0.458 . . . . 0.0 110.449 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.9 mt -81.86 -20.15 39.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.998 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.69 41.77 2.84 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.197 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.424 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 27.9 m -156.76 133.52 10.2 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.641 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.4 m -118.74 122.14 41.75 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -81.06 -24.86 37.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.607 HG23 ' OE1' ' A' ' 7' ' ' GLU . 99.2 t -59.74 128.17 86.17 Favored Pre-proline 0 C--O 1.233 0.221 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -51.68 126.89 20.99 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.542 2.828 . . . . 0.0 114.254 -177.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.0 t0 64.17 11.13 6.03 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 114.499 -1.228 . . . . 0.0 113.059 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 m -89.18 124.9 34.78 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.344 -0.848 . . . . 0.0 111.259 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -89.98 141.23 28.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.621 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.6 t -75.56 112.18 11.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.572 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 54.2 m -111.87 49.78 0.88 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -18.06 129.3 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 113.048 -1.887 . . . . 0.0 114.499 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.02 -17.22 27.96 Favored 'Cis proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.986 -1.673 . . . . 0.0 114.871 -0.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.4 mt -92.81 147.8 5.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.5 m -86.43 134.78 33.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 51.1 mtt -132.82 144.26 50.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.368 0.604 . . . . 0.0 111.249 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -108.53 103.51 12.65 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.374 -178.467 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.409 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.338 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -93.48 118.25 67.53 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 117.222 0.511 . . . . 0.0 110.675 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -74.68 38.84 0.53 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.744 2.296 . . . . 0.0 112.924 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -81.73 52.42 1.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.007 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.5 m -140.06 -43.32 0.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.235 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.32 35.21 76.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.379 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.615 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 19.3 tt0 -121.92 149.3 43.62 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 HG23 ' A' ' 10' ' ' THR . 11.0 m -115.51 107.37 15.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.934 0.397 . . . . 0.0 110.366 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.404 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.3 p -89.17 61.39 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.207 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.518 HG23 HG22 ' A' ' 8' ' ' THR . 1.5 p -57.39 -35.94 70.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.012 0.434 . . . . 0.0 110.577 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.13 -17.79 41.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.83 41.96 3.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.883 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.404 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.0 m -156.13 134.23 11.33 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.313 0.245 . . . . 0.0 110.353 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 36.4 m -118.9 121.02 39.01 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -81.06 -25.26 37.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.063 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.47 HG23 ' OE1' ' A' ' 7' ' ' GLU . 87.5 t -62.76 125.94 87.48 Favored Pre-proline 0 C--O 1.235 0.309 0 CA-C-O 121.028 0.442 . . . . 0.0 109.952 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.23 138.09 64.7 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.711 2.274 . . . . 0.0 112.831 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 33.2 t0 65.65 45.76 2.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.431 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.0 m -143.41 127.25 17.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.688 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -99.79 145.25 27.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.329 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -71.98 117.64 13.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.001 0.429 . . . . 0.0 110.671 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.537 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.2 m -117.93 47.1 1.63 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -16.47 129.06 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.305 0 O-C-N 125.773 1.921 . . . . 0.0 114.718 -176.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -79.55 -21.04 18.33 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.89 -1.713 . . . . 0.0 114.962 -0.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -90.38 148.35 4.61 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.605 0 CA-C-O 121.452 0.644 . . . . 0.0 112.579 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.4 m -86.24 131.08 34.31 Favored 'General case' 0 C--N 1.318 -0.774 0 O-C-N 121.944 -0.472 . . . . 0.0 109.729 178.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.537 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.4 mtm -134.43 142.53 47.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.353 0.597 . . . . 0.0 111.196 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -95.78 101.87 13.6 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.871 178.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.091 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 CA-C-O 120.351 -0.138 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.56 114.46 60.63 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 117.124 0.462 . . . . 0.0 110.724 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.3 Cg_endo -76.29 37.89 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.662 2.241 . . . . 0.0 112.756 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.7 p -86.7 40.1 0.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.124 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.7 m -108.87 -34.55 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.665 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.7 41.4 56.7 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.627 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.8 tt0 -143.99 147.28 33.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.8 p -119.37 111.78 18.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.85 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 13' ' ' THR . 14.3 p -88.55 61.72 6.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.439 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.37 -34.0 70.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 110.43 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.4 mt -80.45 -22.22 41.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.948 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.13 39.07 3.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.273 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 23.0 m -158.9 130.91 6.6 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 122.296 0.238 . . . . 0.0 110.391 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.627 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 58.2 m -111.85 121.78 45.99 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -81.25 -25.75 36.36 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.501 HG23 ' OE1' ' A' ' 7' ' ' GLU . 74.5 t -62.19 124.35 81.9 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-O 121.073 0.463 . . . . 0.0 109.911 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.85 138.69 64.52 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.642 2.228 . . . . 0.0 112.618 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.5 t0 66.85 45.55 1.84 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.403 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.8 m -145.02 130.38 18.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m -97.61 148.63 23.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.523 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -79.75 103.79 9.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.936 0.398 . . . . 0.0 111.056 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.561 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 68.0 m -104.23 52.17 0.76 Allowed 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 178.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 58.5 t90 -22.01 130.3 0.07 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 125.278 1.611 . . . . 0.0 114.142 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -84.75 1.57 62.25 Favored 'Cis proline' 0 C--N 1.346 0.405 0 C-N-CA 123.235 -1.569 . . . . 0.0 115.134 0.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.6 mt -110.5 146.84 15.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 112.182 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 67.7 m -85.43 132.44 34.22 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 121.805 -0.559 . . . . 0.0 110.161 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.1 mtt -133.43 144.54 49.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.173 0.511 . . . . 0.0 111.057 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -102.45 105.43 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.797 -178.807 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.281 -0.177 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -92.73 116.44 66.5 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 117.196 0.498 . . . . 0.0 110.936 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -78.86 40.25 0.91 Allowed 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.776 2.318 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.6 p -85.79 21.93 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.467 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.4 m -89.65 -34.49 16.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.63 37.51 89.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.193 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.634 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 16.9 tt0 -138.24 146.68 42.87 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -117.12 112.53 21.0 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.9 p -88.81 60.65 5.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.9 p -58.15 -35.02 70.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.004 0.43 . . . . 0.0 110.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -20.56 34.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.976 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.55 42.16 2.58 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.213 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 35.4 m -157.93 134.91 9.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.634 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.9 m -120.33 120.92 37.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -81.25 -25.67 36.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.492 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.587 HG23 ' OE1' ' A' ' 7' ' ' GLU . 89.2 t -60.37 126.97 85.76 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 121.022 0.439 . . . . 0.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -43.55 123.93 3.96 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.957 3.104 . . . . 0.0 114.869 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 60.27 15.87 5.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.399 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.3 m -89.24 124.81 34.72 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 121.185 -0.947 . . . . 0.0 110.973 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m -89.79 141.48 28.58 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.617 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -73.97 114.47 12.33 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.16 0.505 . . . . 0.0 110.942 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.575 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.7 m -115.52 48.54 1.18 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.47 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 51.3 t90 -18.94 130.01 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 125.553 1.783 . . . . 0.0 114.443 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 97.2 Cg_endo -82.97 -5.03 51.29 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.168 -1.597 . . . . 0.0 115.15 0.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mt -105.39 149.0 9.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 CA-C-O 121.144 0.497 . . . . 0.0 112.097 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 68.3 m -88.07 133.39 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.737 -0.602 . . . . 0.0 110.347 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.575 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -132.97 142.15 48.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.282 0.563 . . . . 0.0 111.205 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -105.04 106.67 17.27 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.179 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 . . . . . 0 N--CA 1.465 0.31 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.458 -178.779 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 120.501 -0.055 . . . . 0.0 113.083 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.56 115.84 65.28 Favored Pre-proline 0 C--N 1.328 -0.341 0 O-C-N 122.492 -0.417 . . . . 0.0 110.699 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' ' 27' ' ' MET . 74.5 Cg_endo -75.86 36.97 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.624 2.216 . . . . 0.0 112.555 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -86.18 42.05 0.97 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 61.7 m -111.45 -35.49 5.8 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.482 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.0 42.21 69.17 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.429 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -138.55 151.49 47.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.841 0.353 . . . . 0.0 110.465 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.479 HG22 HG23 ' A' ' 10' ' ' THR . 18.7 m -122.42 109.08 13.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.729 -0.668 . . . . 0.0 109.57 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.411 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.5 p -88.81 61.57 6.03 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.423 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.479 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.86 71.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.096 0.474 . . . . 0.0 110.452 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.3 mt -81.84 -20.94 37.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.986 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.79 41.38 2.69 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.001 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 54.2 m -156.46 134.32 11.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 45.3 m -120.22 119.08 32.19 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -81.61 -20.53 39.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.955 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.38 129.61 92.58 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.829 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -47.71 134.0 22.0 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 123.71 2.94 . . . . 0.0 113.967 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.586 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 44.79 34.08 1.11 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.334 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.7 m -108.45 128.33 54.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.172 0.511 . . . . 0.0 110.561 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -92.46 143.92 25.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.871 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.0 t -75.19 110.72 9.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.947 0.403 . . . . 0.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 52.0 m -111.52 49.78 0.87 Allowed 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.3 t90 -18.68 128.65 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.256 0 O-C-N 125.651 1.844 . . . . 0.0 114.451 -176.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -81.22 -19.4 22.58 Favored 'Cis proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.783 -1.757 . . . . 0.0 114.836 -0.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.2 mt -88.67 148.03 4.82 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-O 121.441 0.639 . . . . 0.0 112.713 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.2 m -89.42 132.84 34.8 Favored 'General case' 0 C--N 1.318 -0.764 0 O-C-N 122.017 -0.427 . . . . 0.0 109.945 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.7 mtt -128.14 141.84 51.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 110.754 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.586 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 8.3 ttpt -104.24 104.63 14.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.421 -178.53 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 CA-C-O 120.418 -0.101 . . . . 0.0 113.17 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.74 115.6 64.27 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 117.133 0.466 . . . . 0.0 110.859 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 80.6 Cg_endo -78.89 40.57 0.95 Allowed 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.699 2.266 . . . . 0.0 112.591 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.3 p -85.07 29.92 0.62 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.358 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.4 m -99.36 -35.36 9.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.969 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.85 38.72 75.99 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -138.79 151.92 47.46 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.309 -0.446 . . . . 0.0 110.079 -179.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 t -125.08 114.51 19.16 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.44 0.638 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.4 p -89.5 60.73 5.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.263 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.19 -36.43 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.078 0.466 . . . . 0.0 110.497 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.73 -19.8 37.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.96 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.46 41.98 2.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.235 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.5 m -156.97 134.13 10.43 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 56.5 m -120.46 119.15 32.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -81.46 -20.72 39.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.327 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.7 t -63.23 126.25 88.8 Favored Pre-proline 0 C--O 1.233 0.233 0 CA-C-O 121.0 0.429 . . . . 0.0 110.349 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -43.99 122.53 3.56 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.946 3.098 . . . . 0.0 114.842 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.2 t0 61.48 13.19 4.9 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.4 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 21.2 m -88.74 127.39 35.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.356 -0.84 . . . . 0.0 111.089 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 m -91.02 144.08 26.03 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.872 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.403 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.1 t -75.06 111.14 9.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.045 0.45 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 57.5 m -112.54 50.07 0.89 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.7 t90 -20.57 130.1 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 113.321 -1.763 . . . . 0.0 114.297 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.46 -8.6 45.95 Favored 'Cis proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.042 0.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.1 mt -100.76 148.74 6.67 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.72 133.17 33.9 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 121.822 -0.548 . . . . 0.0 109.764 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 48.1 mtt -134.89 145.66 48.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.255 0.55 . . . . 0.0 111.314 -178.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.36 103.88 13.44 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.032 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.438 -178.674 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 120.325 -0.153 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -97.53 119.56 62.5 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 117.157 0.479 . . . . 0.0 110.567 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.24 36.07 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.703 2.269 . . . . 0.0 112.738 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -84.77 49.34 1.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.831 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 58.6 m -125.29 -37.72 2.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.552 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.34 42.18 75.46 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.519 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -135.81 152.16 50.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.889 0.376 . . . . 0.0 110.27 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.48 HG22 HG23 ' A' ' 10' ' ' THR . 18.3 m -122.66 109.98 14.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.744 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.1 p -88.97 61.61 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.331 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.48 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.55 -36.49 71.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.7 mt -82.72 -19.26 38.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.095 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 42.0 2.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.02 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 52.0 m -156.17 135.18 11.98 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 38.4 m -121.95 118.69 29.46 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -81.67 -20.46 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.178 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 99.1 t -64.02 128.34 92.89 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.504 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_exo -40.68 129.79 2.67 Favored 'Trans proline' 0 C--O 1.237 0.449 0 C-N-CA 124.077 3.185 . . . . 0.0 114.719 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.538 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 43.76 30.78 0.4 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.76 179.257 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 m -101.29 125.65 47.94 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.197 0.523 . . . . 0.0 110.408 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 m -90.04 143.49 26.73 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.851 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.408 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 41.2 t -72.99 114.91 11.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.959 0.409 . . . . 0.0 110.664 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.534 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 67.6 m -115.31 48.0 1.24 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.3 t90 -17.99 128.34 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 125.647 1.842 . . . . 0.0 114.434 -176.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -80.34 -22.57 15.68 Favored 'Cis proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.737 -1.776 . . . . 0.0 114.82 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.9 148.83 4.47 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 CA-C-O 121.454 0.645 . . . . 0.0 112.666 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.4 m -90.41 131.73 36.01 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.886 -0.509 . . . . 0.0 110.004 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 43.6 mtm -129.6 140.1 51.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.431 0.634 . . . . 0.0 110.692 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 11.6 ttpt -101.16 107.96 19.51 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.939 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.686 -178.897 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-O 120.277 -0.18 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 113.74 58.14 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 117.273 0.536 . . . . 0.0 110.929 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.438 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 74.1 Cg_endo -76.48 38.59 0.62 Allowed 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.708 2.272 . . . . 0.0 112.837 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -89.85 35.8 0.85 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.29 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.0 m -102.73 -34.55 8.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.72 40.49 65.37 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.703 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.613 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.9 tt0 -142.04 147.42 36.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.9 p -118.71 112.75 20.17 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.136 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.416 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.6 p -88.7 62.34 6.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.246 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -58.27 -35.01 71.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.069 0.461 . . . . 0.0 110.493 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.6 mt -83.12 -17.66 42.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.025 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.44 40.64 3.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.068 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 22.9 m -157.77 132.3 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.352 0.261 . . . . 0.0 110.353 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.613 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 56.0 m -115.47 120.25 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.9 p90 -81.14 -26.14 36.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.076 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 71.5 t -62.27 118.92 44.72 Favored Pre-proline 0 C--O 1.235 0.296 0 CA-C-O 121.146 0.498 . . . . 0.0 110.513 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -56.0 137.87 80.52 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.116 2.544 . . . . 0.0 112.805 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 42.1 t0 66.12 45.12 2.43 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.498 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 38.9 m -143.92 130.55 20.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.224 0.535 . . . . 0.0 110.81 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.0 m -99.85 146.95 26.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.637 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.55 115.34 16.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.033 0.444 . . . . 0.0 110.959 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.565 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -117.47 50.39 1.12 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -19.94 130.72 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.417 0 CA-C-N 113.21 -1.814 . . . . 0.0 114.4 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.03 -4.31 52.11 Favored 'Cis proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.266 -1.556 . . . . 0.0 115.074 0.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 32.2 mt -106.26 148.7 10.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 CA-C-O 121.265 0.555 . . . . 0.0 112.156 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.3 m -87.24 134.61 33.52 Favored 'General case' 0 C--N 1.319 -0.738 0 O-C-N 121.865 -0.522 . . . . 0.0 110.254 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.565 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 52.9 mtt -132.07 143.04 49.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.24 0.543 . . . . 0.0 111.019 -179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 ttpt -99.1 103.98 15.94 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.85 -179.118 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -94.07 117.19 67.14 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 117.2 0.5 . . . . 0.0 110.916 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.59 40.48 0.92 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.883 2.389 . . . . 0.0 112.413 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.9 p -86.61 22.7 1.83 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.498 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.1 m -89.62 -34.12 16.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.833 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.4 38.82 70.28 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -139.93 152.53 46.45 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.294 -0.453 . . . . 0.0 110.078 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.3 t -126.29 114.84 18.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.453 0.644 . . . . 0.0 109.759 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.45 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 10.3 p -89.49 60.75 5.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.212 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.0 p -57.24 -36.31 70.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.152 0.501 . . . . 0.0 110.428 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.3 mt -81.93 -19.13 41.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.982 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.66 40.5 3.14 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.038 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.2 m -157.51 132.7 8.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 122.17 0.188 . . . . 0.0 110.524 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 53.6 m -117.12 120.26 37.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -81.41 -20.64 39.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.167 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.69 126.67 88.97 Favored Pre-proline 0 C--O 1.233 0.2 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -53.16 127.61 25.78 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.322 2.682 . . . . 0.0 114.013 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.9 t0 66.97 5.48 4.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.604 -1.18 . . . . 0.0 113.134 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.9 m -88.39 129.01 35.52 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 121.488 -0.757 . . . . 0.0 111.186 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.31 143.45 26.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.056 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.445 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.7 t -74.51 115.4 14.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.065 0.46 . . . . 0.0 110.798 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.583 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 60.8 m -117.28 49.51 1.19 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -20.04 129.72 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 125.46 1.725 . . . . 0.0 114.255 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.78 -11.97 40.09 Favored 'Cis proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.105 -1.623 . . . . 0.0 115.174 0.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 31.1 mt -98.24 149.82 5.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.62 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.42 132.27 35.08 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.712 -0.617 . . . . 0.0 109.775 178.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.583 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 42.1 mtm -131.44 144.21 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.455 0.645 . . . . 0.0 111.539 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -106.76 107.53 18.59 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 178.131 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.407 ' CG ' ' HE2' ' A' ' 28' ' ' LYS . 74.2 m-20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.617 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-O 120.276 -0.18 . . . . 0.0 113.369 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -95.16 116.63 66.52 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 117.237 0.518 . . . . 0.0 110.813 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.43 38.19 0.54 Allowed 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.736 2.291 . . . . 0.0 112.871 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.6 p -88.69 40.47 0.97 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.232 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 76.1 m -110.95 -34.57 6.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.694 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 70.33 42.07 66.48 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.995 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 13.3 tt0 -143.02 147.42 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.6 p -118.76 112.46 19.77 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.067 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.408 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.68 62.06 6.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.162 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -58.19 -34.7 70.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.088 0.471 . . . . 0.0 110.509 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.1 mt -82.73 -19.2 38.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.91 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.88 40.26 3.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.093 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.4 m -158.29 132.01 7.75 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 122.346 0.258 . . . . 0.0 110.363 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.622 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 43.7 m -113.89 121.45 44.0 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -81.1 -25.26 37.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.983 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.473 HG23 ' OE1' ' A' ' 7' ' ' GLU . 75.7 t -62.5 124.69 83.8 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.065 0.459 . . . . 0.0 109.834 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.53 138.17 63.59 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.644 2.23 . . . . 0.0 112.746 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 20.1 t0 66.59 44.52 2.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.592 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 m -143.03 130.55 21.19 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.612 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -99.29 145.8 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.864 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.93 116.22 15.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.047 0.451 . . . . 0.0 110.678 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.56 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 65.4 m -117.92 49.45 1.24 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -19.25 130.08 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 114.428 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.96 -5.16 51.12 Favored 'Cis proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.195 -1.585 . . . . 0.0 115.123 0.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.2 mt -105.53 148.97 9.32 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 CA-C-O 121.179 0.514 . . . . 0.0 112.113 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.1 m -87.85 132.18 34.28 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 121.773 -0.579 . . . . 0.0 110.271 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.56 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 45.1 mtm -129.87 141.82 50.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.492 0.663 . . . . 0.0 110.999 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' ASP . 4.3 ttpt -99.02 106.76 19.04 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.845 178.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.005 -179.185 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 CA-C-O 120.318 -0.157 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.75 115.13 63.1 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 117.165 0.483 . . . . 0.0 111.002 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.518 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 82.9 Cg_endo -79.19 39.63 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.768 2.312 . . . . 0.0 112.302 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -85.03 24.16 1.12 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.534 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 82.7 m -89.71 -32.88 16.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.685 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.79 40.77 89.66 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.251 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.6 tt0 -140.4 150.34 43.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.478 HG22 HG23 ' A' ' 10' ' ' THR . 18.1 m -121.42 109.64 15.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.286 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.422 ' HB2' ' H ' ' A' ' 13' ' ' THR . 10.8 p -88.83 62.34 6.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.197 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.478 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -57.74 -35.47 70.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.02 0.438 . . . . 0.0 110.617 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.7 mt -81.29 -20.07 41.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.954 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.42 40.26 3.25 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.08 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 29.7 m -157.75 129.28 6.8 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 122.219 0.208 . . . . 0.0 110.498 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.591 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 26.7 m -113.56 123.35 49.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -81.43 -23.0 37.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 ' OE2' ' A' ' 7' ' ' GLU . 59.9 t -58.78 127.29 82.58 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.734 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.31 128.3 29.44 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.369 2.712 . . . . 0.0 114.288 -178.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t0 64.99 6.77 3.6 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.581 -1.19 . . . . 0.0 113.307 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -88.71 126.24 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.612 -0.68 . . . . 0.0 111.262 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.67 140.23 29.96 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.684 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.7 t -74.77 114.2 12.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.051 0.453 . . . . 0.0 110.629 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 59.8 m -114.51 49.98 0.99 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.471 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 49.3 t90 -18.14 129.14 0.04 OUTLIER Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 113.139 -1.846 . . . . 0.0 114.486 -176.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 83.3 Cg_endo -80.63 -18.71 24.09 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 C-N-CA 122.893 -1.711 . . . . 0.0 115.016 0.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.3 mt -91.98 147.72 5.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.5 m -87.18 134.34 33.54 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -131.49 143.12 50.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.346 0.593 . . . . 0.0 111.307 -179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.48 103.81 13.36 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.313 -178.507 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.358 -0.134 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.86 115.25 63.44 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 117.075 0.437 . . . . 0.0 110.918 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.537 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 79.4 Cg_endo -79.22 39.55 0.83 Allowed 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.735 2.29 . . . . 0.0 112.38 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.6 p -85.48 25.86 0.99 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.427 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 81.5 m -89.74 -32.94 16.76 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.925 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.84 41.55 82.29 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.18 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.597 ' OE1' ' HA ' ' A' ' 14' ' ' CYS . 2.7 tt0 -142.18 155.01 45.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.483 HG22 HG23 ' A' ' 10' ' ' THR . 25.0 m -126.89 110.11 12.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.33 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 13' ' ' THR . 9.5 p -88.93 62.89 6.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.301 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.483 HG23 HG22 ' A' ' 8' ' ' THR . 1.4 p -58.01 -35.77 71.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.004 0.431 . . . . 0.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -81.18 -20.14 41.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.952 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.29 39.78 3.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.42 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 24.1 m -157.66 129.1 6.78 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 122.238 0.215 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HA ' ' OE1' ' A' ' 7' ' ' GLU . 29.7 m -112.65 123.52 50.49 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -81.34 -23.55 37.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.52 HG23 ' OE2' ' A' ' 7' ' ' GLU . 62.5 t -58.23 126.74 79.06 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.686 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.73 129.41 34.88 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.344 2.696 . . . . 0.0 114.338 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.6 t0 65.3 5.09 2.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.559 -1.201 . . . . 0.0 113.429 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.3 m -88.3 126.78 35.35 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.55 -0.719 . . . . 0.0 111.29 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 m -90.7 140.07 30.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.704 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.7 115.66 14.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.035 0.445 . . . . 0.0 110.712 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 62.4 m -116.07 49.98 1.07 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 178.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.472 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.5 t90 -17.77 128.76 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 113.059 -1.882 . . . . 0.0 114.51 -176.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 85.1 Cg_endo -81.27 -18.85 23.95 Favored 'Cis proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.889 -1.713 . . . . 0.0 114.866 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.5 mt -90.75 147.87 4.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.0 m -88.02 134.45 33.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.8 mtt -130.88 142.8 50.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.311 0.577 . . . . 0.0 111.419 -179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -107.1 103.41 12.81 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 177.995 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.315 -178.435 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-O 120.36 -0.133 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.73 115.11 63.06 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 117.107 0.454 . . . . 0.0 110.9 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.464 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.5 Cg_endo -79.22 40.12 0.9 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.716 2.277 . . . . 0.0 112.405 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.1 p -85.78 23.14 1.48 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.472 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 70.0 m -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.84 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 69.45 38.25 79.76 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.643 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 17.2 tt0 -139.98 148.84 42.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -120.99 114.2 21.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.31 0.576 . . . . 0.0 110.002 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.2 p -89.6 60.17 5.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.285 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.2 p -57.64 -35.81 71.0 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.119 0.485 . . . . 0.0 110.379 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.0 mt -81.62 -21.08 38.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.918 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.35 41.58 2.54 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.199 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.5 m -157.96 133.77 9.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.242 0.217 . . . . 0.0 110.468 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.643 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.4 m -118.59 121.06 39.3 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -81.19 -25.64 36.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.346 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.575 HG23 ' OE1' ' A' ' 7' ' ' GLU . 95.4 t -60.3 124.29 77.24 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-O 121.067 0.46 . . . . 0.0 110.422 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -45.65 126.37 8.77 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.824 3.016 . . . . 0.0 114.691 -178.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.2 t0 63.64 8.89 3.94 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.511 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -88.33 126.49 35.22 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.374 -0.829 . . . . 0.0 111.175 179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.5 m -90.21 144.41 25.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.797 -179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.402 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 42.2 t -76.65 111.94 12.69 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.028 0.442 . . . . 0.0 110.977 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.562 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 56.9 m -112.96 50.65 0.87 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.1 t90 -20.69 130.44 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.304 0 CA-C-N 113.277 -1.783 . . . . 0.0 114.284 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -82.57 -6.95 48.12 Favored 'Cis proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.094 -1.628 . . . . 0.0 115.086 0.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.3 mt -103.4 148.55 8.27 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 CA-C-O 121.258 0.551 . . . . 0.0 112.381 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -86.55 133.61 33.71 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 121.86 -0.525 . . . . 0.0 109.889 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.562 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 50.1 mtt -134.03 142.92 47.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 111.249 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.534 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -105.37 104.24 13.92 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.406 -178.486 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.395 0 CA-C-O 120.398 -0.112 . . . . 0.0 113.155 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 2' ' ' LEU . 3.0 mm? -89.72 115.94 65.12 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 117.074 0.437 . . . . 0.0 110.793 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.411 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 81.1 Cg_endo -78.69 40.34 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.688 2.259 . . . . 0.0 112.57 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.4 p -84.66 31.85 0.52 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.285 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.67 -35.39 9.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.922 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 68.96 38.54 84.82 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.234 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.645 ' OE2' ' HA ' ' A' ' 14' ' ' CYS . 18.0 tt0 -139.46 148.99 43.48 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 t -120.88 114.44 21.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.421 0.629 . . . . 0.0 109.871 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.424 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 13.7 p -89.58 60.47 5.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.268 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -57.46 -36.12 71.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.107 0.48 . . . . 0.0 110.452 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.24 -20.85 36.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.925 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.42 42.12 2.42 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.291 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.4 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 36.0 m -157.52 134.32 10.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.421 -0.215 . . . . 0.0 110.421 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.645 ' HA ' ' OE2' ' A' ' 7' ' ' GLU . 57.2 m -119.89 120.85 37.62 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -81.38 -25.4 36.32 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.302 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.591 HG23 ' OE1' ' A' ' 7' ' ' GLU . 98.3 t -60.15 125.1 80.38 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.072 0.463 . . . . 0.0 110.429 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.96 125.31 6.56 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 123.903 3.068 . . . . 0.0 114.779 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.1 t0 62.55 10.76 4.27 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.551 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.9 m -88.5 125.97 35.02 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.271 -0.893 . . . . 0.0 111.047 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 m -89.96 144.68 25.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.8 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -76.14 111.17 11.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.006 0.432 . . . . 0.0 110.901 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.556 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 61.5 m -111.96 50.29 0.86 Allowed 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -20.5 130.35 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.333 0 CA-C-N 113.259 -1.791 . . . . 0.0 114.274 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.52 -6.96 47.99 Favored 'Cis proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.158 -1.601 . . . . 0.0 115.129 0.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 29.6 mt -103.1 148.7 7.88 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-O 121.26 0.552 . . . . 0.0 112.318 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.5 m -86.59 133.55 33.71 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.857 -0.527 . . . . 0.0 109.966 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 49.6 mtt -135.17 144.77 47.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.276 0.56 . . . . 0.0 111.19 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.548 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -106.23 103.47 12.94 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.144 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.408 -178.701 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.434 0 CA-C-O 120.339 -0.145 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.58 112.86 59.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 117.128 0.464 . . . . 0.0 110.895 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -74.45 40.67 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.687 2.258 . . . . 0.0 112.609 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.1 p -96.91 34.41 1.72 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 28' ' ' LYS . 57.6 m -101.72 -38.26 7.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.91 37.28 56.89 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.55 ' OE1' ' HB3' ' A' ' 14' ' ' CYS . 55.0 tt0 -133.54 152.75 51.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.63 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.4 p -128.69 115.1 17.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.251 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 11.7 p -89.22 61.43 5.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.053 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.9 p -57.1 -36.85 71.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.938 0.399 . . . . 0.0 110.548 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.4 mt -83.78 -18.31 38.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.756 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 100.32 41.14 2.84 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.151 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.413 ' H ' ' HB2' ' A' ' 9' ' ' CYS . 52.1 m -156.45 133.19 10.26 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.874 -0.191 . . . . 0.0 110.854 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.55 ' HB3' ' OE1' ' A' ' 7' ' ' GLU . 31.8 m -121.97 119.41 31.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.3 p90 -81.91 -20.24 39.16 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.487 -178.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.2 t -64.55 121.41 72.72 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.222 0.534 . . . . 0.0 110.818 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.74 133.43 44.75 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.434 2.756 . . . . 0.0 113.681 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.598 ' HB3' ' HD2' ' A' ' 28' ' ' LYS . 29.7 t70 71.52 -5.18 1.68 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.347 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 62.2 m -88.2 129.3 35.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.569 0.699 . . . . 0.0 110.915 179.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m -100.27 148.78 24.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.818 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 40.4 t -75.03 116.57 15.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.931 0.396 . . . . 0.0 110.823 179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB2' ' HG3' ' A' ' 27' ' ' MET . 50.5 m -121.0 49.48 1.48 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 50.8 t90 -19.29 129.92 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.4 0 O-C-N 125.569 1.793 . . . . 0.0 114.459 -177.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HA ' ' HA ' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -81.84 -13.68 36.73 Favored 'Cis proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.174 -1.594 . . . . 0.0 114.827 0.023 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.3 mt -94.63 150.02 4.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 121.214 0.531 . . . . 0.0 112.25 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.8 m -92.78 128.5 38.66 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 121.798 -0.564 . . . . 0.0 110.337 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.528 ' HG3' ' HB2' ' A' ' 22' ' ' SER . 53.4 mtt -118.49 135.07 54.59 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HD2' ' HB3' ' A' ' 18' ' ' ASP . 10.4 ttpp -89.19 99.81 12.72 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.432 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.344 -178.797 . . . . . . . . 0 0 . 1 stop_ save_